SCHEMBL8326162

SCHEMBL8326162

O=C1Nc2ncccc2C1=Cc1c[nH]c2nccc(S(=O)(=O)O)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.49
CTRC Q99895 1/20 0.47
MAPT P10636 3/20 0.46
APP P05067 2/20 0.46
SNCA P37840 2/20 0.46
NTRK1 P04629 3/20 0.45
RAF1 P04049 1/20 0.45
FLT3 P36888 2/20 0.40
CHEK2 O96017 1/20 0.39
CDK1 P06493 1/20 0.39
SRC P12931 1/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
HASPIN Q8TF76 3/20 0.36
CCNT1 O60563 2/20 0.36
CDK9 P50750 2/20 0.36
JAK3 P52333 1/20 0.35
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL8322104 0.91 CHEK1 (0.50) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8321481 0.85 CHEK1 (0.53) CHEK1CTRCMAPTAPPSNCA
SCHEMBL9046803 0.83 CTRC (0.41) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8320628 0.83 CHEK1 (0.53) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8319684 0.82 CHEK1 (0.50) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8318087 0.81 CHEK1 (0.49) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8319826 0.80 CHEK1 (0.50) CHEK1CTRCMAPTAPPSNCA
SCHEMBL6288777 0.79 CHEK1 (0.76) CHEK1CTRCMAPTAPPSNCA
SCHEMBL6288779 0.79 CHEK1 (0.76) CHEK1CTRCMAPTAPPSNCA
SCHEMBL8320797 0.76 CTRC (0.48) CHEK1CTRCMAPTAPPSNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741726-B1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-11-17 EP claimed
EP-0741726-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1996-11-13 EP claimed
WO-1996016964-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A (IT) 1996-06-06 WO claimed
EP-0741726-B1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-11-17 EP disclosed
US-5719135-A TYROSINE KINASE INHIBITORS PHARMACIA S.P.A. (IT) 1998-02-17 US disclosed
WO-1996016964-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A (IT) 1996-06-06 WO disclosed