SCHEMBL9682989

SCHEMBL9682989

COc1cc(OC)nc(Nc2ccccc2C(=O)O)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
APAF1 O14727 1/20 0.55
RECQL P46063 1/20 0.55
CASP6 P55212 1/20 0.55
CACNA1B Q00975 1/20 0.55
APBA1 Q02410 1/20 0.55
MCL1 Q07820 1/20 0.55
CASP8 Q14790 1/20 0.55
CDC25B P30305 2/20 0.54
AURKA O14965 2/20 0.52
FABP4 P15090 2/20 0.50
FABP3 P05413 1/20 0.50
FABP5 Q01469 1/20 0.50
CDC7 O00311 2/20 0.49
AURKB Q96GD4 1/20 0.49
PIM1 P11309 2/20 0.49
CLK4 Q9HAZ1 2/20 0.49
MAPK8 P45983 2/20 0.49
CLCN2 P51788 1/20 0.49
CHEK1 O14757 1/20 0.49

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
SCHEMBL29603638 0.82 AURKA (0.66) KDM4ECDC25BAURKAFABP4FABP3
SCHEMBL5686015 0.82 AURKA (0.66) KDM4ECDC25BAURKAFABP4FABP3
SCHEMBL3882260 0.80 MEN1 (0.65) AURKAFABP4CDC7AURKBPIM1
SCHEMBL9682499 0.78 PBRM1 (0.51) FABP4FABP3
SCHEMBL14008602 0.76 AURKA (0.59) KDM4ECDC25BAURKAFABP4FABP3
SCHEMBL21925300 0.76 AURKA (0.59) KDM4ECDC25BAURKAFABP4FABP3
SCHEMBL9698720 0.75 CDC7 (0.58) KDM4EAURKAFABP4FABP3FABP5
SCHEMBL20481871 0.75 AURKA (0.57) KDM4ECDC25BAURKAFABP4FABP3
SCHEMBL4104554 0.75 TSHR (0.59) KDM4EAURKAFABP4FABP3FABP5
SCHEMBL10084236 0.74 KMT2A (0.69) KDM4EAPAF1RECQLCASP6CACNA1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121652098-A Synthesis method of nafamostat mesylate 鲁南制药集团股份有限公司 2026-03-13 CN disclosed
US-5149357-A Herbicidal substituted benzoylsulfonamides FMC CORPORATION (US) 1992-09-22 US disclosed
WO-1991013065-A1 6-ARYL-2-SUBSTITUTED BENZOIC ACID HERBICIDES FMC CORPORATION (US) 1991-09-05 WO disclosed