SCHEMBL8547853

SCHEMBL8547853

CNc1c(Cl)cnn(C)c1=O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 6/20 0.58
KAT2B Q92831 12/20 0.58
BRD9 Q9H8M2 4/20 0.58
BRD4 O60885 3/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
PDE2A O00408 1/20 0.38

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
SCHEMBL4170118 0.79 BPTF (0.52) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL979278 0.75 KAT2B (0.60) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL9982965 0.75 BPTF (0.68) BPTFKAT2BBRD9BRD4
SCHEMBL9124850 0.75 BPTF (0.68) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL3249795 0.74 BPTF (0.66) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL9123299 0.74 BPTF (0.66) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL8544499 0.74 BRD9 (0.48) BPTFKAT2BBRD9BRD4ALDH1A1
Hydrochloric Acid SCHEMBL17912386 0.74 KAT2B (0.58) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL2642056 0.74 KAT2B (0.53) BPTFKAT2BBRD9BRD4ALDH1A1
SCHEMBL17912381 0.72 KAT2B (0.47) BPTFKAT2BBRD9BRD4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717734-B1 PYRIDAZINONE DERIVATIVES OR THEIR SALTS, PROCESSES FOR THEIR PRODUCTION, AND ANTI-SHOCK AGENTS CONTAINING THEM ISHIHARA SANGYO KAISHA (JP) 1998-11-18 EP disclosed
US-5763439-A POTENTIATION ISHIHARA SANGYO KAISHA LTD. (JP) 1998-06-09 US disclosed
EP-0717734-A1 PYRIDAZINONE DERIVATIVES OR THEIR SALTS, PROCESSES FOR THEIR PRODUCTION, AND ANTI-SHOCK AGENTS CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 1996-06-26 EP disclosed
WO-1995007264-A1 PYRIDAZINONE DERIVATIVES OR THEIR SALTS, PROCESSES FOR THEIR PRODUCTION, AND ANTI-SHOCK AGENTS CONTAINING THEM ISHIHARA SANGYO KAISHA LTD. (JP) 1995-03-16 WO disclosed