SCHEMBL74518

SCHEMBL74518

CCc1ccc2nccn2c1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.68
DYRK1A Q13627 2/20 0.49
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
KMT2A Q03164 1/20 0.46
MERTK Q12866 10/20 0.46
AXL P30530 9/20 0.44
FLT3 P36888 9/20 0.44
DAO P14920 1/20 0.44
CPB2 Q96IY4 1/20 0.43
RET P07949 1/20 0.42
MET P08581 2/20 0.40
TYRO3 Q06418 2/20 0.40
NAMPT P43490 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Ammonia Solution, Strong SCHEMBL28922912 0.98 KEAP1 (0.66) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL24484881 0.85 KEAP1 (0.64) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL21099155 0.81 KEAP1 (0.58) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL14554770 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL2535366 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL25804613 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL14638413 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL24494597 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL6092812 0.81 KEAP1 (1.00) KEAP1DYRK1AMEN1CYP1A2KMT2A
SCHEMBL2049672 0.81 KEAP1 (0.68) KEAP1DYRK1AMEN1CYP1A2KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 370 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030853-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2024-07-09 US disclosed
US-12022728-B2 Organic electroluminescent element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2024-06-25 US disclosed
WO-2023227696-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
US-20230382923-A1 FUSED TETRACYCLIC QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ENLIVEN INC. 2023-11-30 US disclosed
WO-2023230540-A2 INDAZOLE DERIVATIVES FOR TREATING TRPM3-MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed
US-11820757-B2 Antagonists of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2023-11-21 US disclosed
US-11807641-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-11-07 US disclosed
US-20230312522-A1 CYP46A1 INHIBITORS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2023-10-05 US disclosed
US-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-09-28 US disclosed
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-09-21 US disclosed
US-20070132372-A1 AMINE BASED COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-06-14 US disclosed
US-20070134511-A1 Organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-06-14 US disclosed
US-20070111028-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-05-17 US disclosed
US-20070103065-A1 Organic electroluminescent device and display using same IDEMITSU KOSAN CO., LTD. (JP) 2007-05-10 US disclosed
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-04-19 US disclosed
US-20070063638-A1 White color organic electroluminescence device IDEMITSU KOSAN CO., LTD. (JP) 2007-03-22 US disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-20070029927-A1 AROMATIC AMINE DERIVATIVES AND ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-02-08 US disclosed
US-20070013296-A1 Biphenyl derivative, material for organic electroluminescence device, and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2007-01-18 US disclosed
US-20070007882-A1 Organic electroluminescent device and display using same IDEMITSU KOSAN CO., LTD. (JP) 2007-01-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, CYP4F11, WEE1 KEAP1 887/4885DYRK1A 4733/4885MEN1 479/4885
US-11820757-B2 Antagonists of the muscarinic acetylcholine receptor M4 CHRM2, CHRM3, CHRM4 KEAP1 3507/4885DYRK1A 2496/4885MEN1 1500/4885
US-20070132372-A1 AMINE BASED COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME KCNH2, SLC7A5, KCNH3 KEAP1 1057/4885DYRK1A 678/4885MEN1 1092/4885
US-20230312522-A1 CYP46A1 INHIBITORS AND METHODS OF USE THEREOF CYP46A1, CYP26A1, CYP4A22 KEAP1 170/4885DYRK1A 2685/4885MEN1 4442/4885
US-11807641-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 KEAP1 1968/4885DYRK1A 3476/4885MEN1 150/4885
US-20230295122-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 KEAP1 1704/4885DYRK1A 4004/4885MEN1 3868/4885
US-20070111028-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, TYR, OCIAD2 KEAP1 3197/4885DYRK1A 166/4885MEN1 2266/4885
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same RABGGTA, ALAD, GCDH KEAP1 2838/4885DYRK1A 1301/4885MEN1 3242/4885
US-20070029927-A1 AROMATIC AMINE DERIVATIVES AND ELECTROLUMINESCENCE DEVICE USING THE SAME TYR, MAOA, MAOB KEAP1 1627/4885DYRK1A 786/4885MEN1 1697/4885
US-12022728-B2 Organic electroluminescent element and electronic device L1CAM, ESR1, LEF1 KEAP1 693/4885DYRK1A 4125/4885MEN1 635/4885
US-20070013296-A1 Biphenyl derivative, material for organic electroluminescence device, and organic electroluminescence device using the same EED, BMI1, EBPL KEAP1 734/4885DYRK1A 2225/4885MEN1 2736/4885
US-20230382923-A1 FUSED TETRACYCLIC QUINAZOLINE DERIVATIVES AS INHIBITORS OF ERBB2 ERBB2, ERBB3, BRCA1 KEAP1 428/4885DYRK1A 495/4885MEN1 1359/4885
US-12030853-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 KEAP1 1968/4885DYRK1A 3476/4885MEN1 150/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.