SCHEMBL3076973

SCHEMBL3076973

N=C(N)c1ccc2ccccc2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.57
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
GAA P10253 1/20 0.55
CNR2 P34972 4/20 0.52
HDAC8 Q9BY41 1/20 0.52
LMNA P02545 1/20 0.50
NCF1 P14598 1/20 0.48
NOS2 P35228 1/20 0.48
BACE1 P56817 1/20 0.48
KDM4E B2RXH2 2/20 0.47
NFKB1 P19838 1/20 0.47
RAB9A P51151 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4C Q9H3R0 1/20 0.45
F2 P00734 1/20 0.44
PLG P00747 1/20 0.44
PLAU P00749 1/20 0.44

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
Hydrochloric Acid SCHEMBL5729637 0.98 MGAM (0.55) MGAMALDH1A1MAPTGAACNR2
Hydrochloric Acid SCHEMBL6009217 0.98 MGAM (0.55) MGAMALDH1A1MAPTGAACNR2
Acetic Acid SCHEMBL17984568 0.89 MGAM (0.61) MGAMALDH1A1MAPTGAACNR2
SCHEMBL367913 0.79 MGAM (0.68) MGAMALDH1A1MAPTGAACNR2
SCHEMBL29540332 0.79 MGAM (0.68) MGAMALDH1A1MAPTGAACNR2
SCHEMBL867190 0.79 LMNA (0.59) MGAMALDH1A1MAPTGAACNR2
SCHEMBL4903234 0.79 ALDH1A1 (0.64) MGAMALDH1A1MAPTGAACNR2
SCHEMBL24565009 0.78 MGAM (0.47) MGAMALDH1A1MAPTGAACNR2
SCHEMBL5788456 0.78 MGAM (0.66) MGAMALDH1A1MAPTGAACNR2
Hydrochloric Acid SCHEMBL3401098 0.78 MGAM (0.66) MGAMALDH1A1MAPTGAACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100475207-C 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2009-04-08 CN claimed
CN-1655788-A 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2005-08-17 CN claimed
EP-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP claimed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP claimed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO claimed
JP-1066181-A None JP disclosed
EP-3497094-B1 TLR7/8 ANTAGONISTS AND USES THEREOF MERCK PATENT GMBH (DE) 2023-02-15 EP disclosed
CN-113491766-A Vaccine compositions and methods for restoring function of the NKG2D pathway against cancer 达纳-法伯癌症研究所公司 2021-10-12 CN disclosed
CN-108699041-B Imidazole derivative having JNK inhibitory activity and use thereof 三进制药株式会社 2021-03-26 CN disclosed
EP-3409668-B1 NOVEL IMIDAZOLE DERIVATIVE HAVING JNK INHIBITORY ACTIVITY AND USE THEREOF SAMJIN PHARM CO LTD (KR) 2020-10-21 EP disclosed
CN-110099898-A compound and use thereof 优曼尼蒂治疗公司 2019-08-06 CN disclosed
US-10301291-B2 Imidazole derivative having JNK inhibitory activity and use thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2019-05-28 US disclosed
CN-100475207-C 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2009-04-08 CN disclosed
CN-101171254-A Fused thieno[2,3-B]pyridine and thiazolo[5,4-B]pyridine compounds for inhibiting KSP kinesin activity SCHERING CORP (US) 2008-04-30 CN disclosed
WO-2007072041-A1 THERAPEUTIC COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2007-06-28 WO disclosed
CN-1655788-A 1H-imidazo[4,5-c]quinoline derivatives in the treatment of protein kinase dependent diseases NOVARTIS AG (CH) 2005-08-17 CN disclosed
EP-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP disclosed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP disclosed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO disclosed
JP-S6466181-A QUINOLYPYRIMIDINE DERIVATIVE, ITS PRODUCTION AND PLANT BLIGHT CONTROLLING AGENT CONTAINING SAID DERIVATIVE AS ACTIVE COMPONENT SUMITOMO CHEMICAL CO 1989-03-13 JP 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 (1 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-10301291-B2 Imidazole derivative having JNK inhibitory activity and use thereof MAPKAPK2, MAPKAPK3, MAP3K7 MGAM 3555/4885ALDH1A1 3334/4885MAPT 237/4885

“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.