SCHEMBL692480

SCHEMBL692480

c1ccc(Nc2cc[nH]n2)nc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
MAPK10 P53779 1/20 0.53
GFER P55789 1/20 0.53
ADRA2A P08913 2/20 0.46
ADRA2B P18089 2/20 0.46
ADRA2C P18825 2/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
ALOX15 P16050 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.45
KLF5 Q13887 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL31134966 1.00 KMT2A (0.53) KMT2AMEN1MAPK10GFERADRA2A
Isoquinoline SCHEMBL28496428 0.85 NPC1 (0.42) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL13716220 0.82 APAF1 (0.46) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL221242 0.81 KMT2A (0.76) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL1272593 0.81
SCHEMBL29391624 0.81 KMT2A (0.76) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL589542 0.80 ACHE (0.36) KMT2AMEN1MAPK10GFERNPC1
SCHEMBL11133606 0.79 KMT2A (0.73) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL6574416 0.79 KMT2A (0.73) KMT2AMEN1MAPK10GFERADRA2A
SCHEMBL30947359 0.79 KMT2A (0.73) KMT2AMEN1MAPK10GFERADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2295425-B1 1-SUBSTITUTED PYRIDYL-PYRAZOLYL AMIDE COMPOUND AND USES THEREOF SHENYANG SCIENCREAT CHEMICALS CO LTD (CN) 2016-09-07 EP claimed
EP-0745067-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AG (DE) 1996-12-04 EP claimed
WO-1995022530-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1995-08-24 WO claimed
JP-8208620-A None JP disclosed
US-20250177396-A1 POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF REPARE THERAPEUTICS INC. (CA) 2025-06-05 US disclosed
EP-4482833-A1 POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF Repare Therapeutics Inc. (CA) 2025-01-01 EP disclosed
WO-2023159307-A9 POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF REPARE THERAPEUTICS INC. (CA) 2024-03-21 WO disclosed
WO-2023159307-A1 POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF REPARE THERAPEUTICS INC. (CA) 2023-08-31 WO disclosed
CN-112079775-B Synthesis method of 5-trifluoromethyl isoquinoline-8-formic acid 苏州康润医药有限公司 2022-11-22 CN disclosed
US-10448639-B2 Fungicidal pyrazoles FMC CORPORATION (US) 2019-10-22 US disclosed
EP-2589592-B1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM CORP (JP) 2018-08-22 EP disclosed
US-20080139561-A1 e.g. 6-(5-Cyclopropyl-1H-pyrazol-3-ylamino)-5-fluoro-2-(1-(4-fluorophenyl)ethylamino) nicotinonitrile; tropomyosin-related kinases (Trk's) inhibitor; anticarcinogenic agent; hormone related cancer, leukemia; antiinflammatory agent; arthritis, restenosis; autoimmune diseases ASTRAZENECA AB (SE) 2008-06-12 US disclosed
CN-101155800-A Pyrazolylaminopyridine derivatives useful as kinase inhibitors ASTRAZENECA AB (SE) 2008-04-02 CN disclosed
US-5849778-A N-pyrazolyl anilines as pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
US-5849778-A N-pyrazolyl anilines as pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
EP-0745067-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AG (DE) 1996-12-04 EP disclosed
EP-0745067-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AG (DE) 1996-12-04 EP disclosed
JP-H08208620-A AMINOPYRAZOLE DERIVATIVE, ITS PRODUCTION AND USE TAKEDA CHEM IND LTD 1996-08-13 JP disclosed
WO-1995022530-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1995-08-24 WO disclosed
WO-1995022530-A1 N-PYRAZOLYL ANILINES AND N-PYRAZOLYL AMINOPYRIDINES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1995-08-24 WO 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 (3 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-20080139561-A1 e.g. 6-(5-Cyclopropyl-1H-pyrazol-3-ylamino)-5-fluoro-2-(1-(4-fluorophenyl)ethylamino) nicotinonitrile; tropomyosin-related kinases (Trk's) inhibitor; anticarcinogenic agent; hormone related cancer, leukemia; antiinflammatory agent; arthritis, restenosis; autoimmune diseases CNKSR1, LTK, MUSK KMT2A 3042/4885MEN1 2827/4885MAPK10 109/4885
US-20250177396-A1 POLO-LIKE KINASE 4 (PLK4) INHIBITORS, PHARMACEUTICAL COMPOSITIONS, METHODS OF PREPARATION AND USES THEREOF PLK4, PLK2, PLK3 KMT2A 1433/4885MEN1 3882/4885MAPK10 1333/4885
US-10448639-B2 Fungicidal pyrazoles CBR3, CBR1, CYP2S1 KMT2A 2374/4885MEN1 3046/4885MAPK10 3855/4885

“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.