SCHEMBL7834239

SCHEMBL7834239

Clc1ccc(OCc2nc3ccc(-n4ccnc4)cc3[nH]2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
USP2 O75604 1/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 1/20 0.55
HSD17B10 Q99714 1/20 0.55
BRS3 P32247 3/20 0.51
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
CBFB Q13951 1/20 0.47
F9 P00740 1/20 0.43
FGFR1 P11362 1/20 0.42
FLT1 P17948 1/20 0.42
NOTUM Q6P988 1/20 0.41
IDO1 P14902 1/20 0.41
IDH1 O75874 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
Hydrochloric Acid SCHEMBL8149767 0.99 USP2 (0.54) MEN1USP2MAPTKMT2AHSD17B10
SCHEMBL7834232 0.92 RAB9A (0.47) MEN1USP2MAPTKMT2AHSD17B10
Hydrochloric Acid SCHEMBL8149760 0.91 RAB9A (0.47) MEN1USP2MAPTKMT2AHSD17B10
SCHEMBL7834561 0.86 RAB9A (0.56) MEN1KMT2ABRS3RAB9ANPC1
Hydrochloric Acid SCHEMBL8149755 0.85 RAB9A (0.55) MEN1KMT2ABRS3RAB9ANPC1
SCHEMBL7834178 0.83 CBFB (0.52) MEN1USP2MAPTKMT2AHSD17B10
Hydrochloric Acid SCHEMBL8157014 0.82 CBFB (0.51) BRS3RAB9ANPC1CBFBF9
SCHEMBL7821732 0.80 RAB9A (0.58) MEN1KMT2ARAB9ANPC1CBFB
Hydrochloric Acid SCHEMBL8159913 0.79 RAB9A (0.57) MEN1KMT2ARAB9ANPC1CBFB
SCHEMBL7836455 0.79 CBFB (0.52) MEN1MAPTKMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0894795-B1 Benzimidazole, benzoxazole and benzothiazole derivatives, their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-06-06 EP disclosed
EP-0894795-A1 Benzimidazole, benzoxazole and benzothiazole derivatives, their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-02-03 EP disclosed