SCHEMBL8549481

SCHEMBL8549481

Cn1ncc(Cl)c(CO)c1=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 6/20 0.45
KAT2B Q92831 5/20 0.43
BRD9 Q9H8M2 4/20 0.43
ALDH1A1 P00352 3/20 0.40
HPGD P15428 1/20 0.40
BRD4 O60885 5/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
HTT P42858 2/20 0.37
NPC1 O15118 1/20 0.37
MITF O75030 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL31735616 0.83 BPTF (0.46) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL8544138 0.81 BPTF (0.45) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL8544525 0.81 SMN1; SMN2 (0.40) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL8550013 0.79 ALDH1A1 (0.44) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL3846274 0.77 SMN1; SMN2 (0.41) ALDH1A1HPGDGAASMN1; SMN2HTT
SCHEMBL2642058 0.75 KAT2B (0.47) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL4163687 0.75 KAT2B (0.47) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL979278 0.74 KAT2B (0.60) BPTFKAT2BBRD9ALDH1A1HPGD
SCHEMBL29451307 0.74 ALDH1A1 (0.48) ALDH1A1HPGDMAPTSMN1; SMN2HTT
Hydrochloric Acid SCHEMBL17912386 0.72 KAT2B (0.58) BPTFKAT2BBRD9ALDH1A1HPGD

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