SCHEMBL9301797

SCHEMBL9301797

CCOC(=O)c1ccc(Cc2nc3ccccc3[nH]2)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.58
MAPT P10636 5/20 0.58
NPC1 O15118 5/20 0.58
ALDH1A1 P00352 3/20 0.58
LMNA P02545 2/20 0.58
MAPK1 P28482 1/20 0.58
TSHR P16473 1/20 0.54
MAPK10 P53779 1/20 0.54
POLB P06746 1/20 0.54
HSD17B10 Q99714 3/20 0.53
HSD17B2 P37059 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
HCRTR1 O43613 1/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
GCGR P47871 1/20 0.45
THRB P10828 1/20 0.45

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
SCHEMBL9304019 0.86 MAPT (0.59) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL9303210 0.86 MAPT (0.59) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL9302827 0.82 MAPT (0.71) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL9302971 0.81 MAPT (0.60) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL8992779 0.78 HSD17B2 (0.61) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL6171488 0.78 MAPT (0.56) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL6171495 0.78 GAA (0.59) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL9301352 0.77 TSHR (0.48) RAB9ANPC1ALDH1A1LMNATSHR
SCHEMBL8993227 0.76 HSD17B2 (0.58) RAB9AMAPTNPC1ALDH1A1LMNA
SCHEMBL2878961 0.73 HSD17B10 (0.66) RAB9AMAPTNPC1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed