SCHEMBL8435128

SCHEMBL8435128

COc1cc2nc(N)sc2cc1OC(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.55
RAB9A P51151 5/20 0.55
NPC1 O15118 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
TP53 P04637 3/20 0.55
SCN4A P35499 3/20 0.55
CYP1A2 P05177 2/20 0.55
ALOX15 P16050 2/20 0.55
HSD17B10 Q99714 2/20 0.55
GMNN O75496 1/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
ADORA3 P0DMS8 1/20 0.55
GAA P10253 1/20 0.55
CYP2C9 P11712 1/20 0.55
PKM P14618 1/20 0.55
NFKB1 P19838 1/20 0.55
SLC6A2 P23975 1/20 0.55
BLM P54132 1/20 0.55
PMP22 Q01453 1/20 0.55

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
SCHEMBL9722790 0.87 CYP3A4 (0.59) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL31114638 0.87 CYP3A4 (0.59) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL9474730 0.83 RAB9A (0.59) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL16276940 0.81 RAB9A (0.56) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL8433950 0.81 RAB9A (0.56) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL5683354 0.81 CYP3A4 (0.49) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL17610032 0.81 RAB9A (0.56) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL2552313 0.78 CYP3A4 (0.53) CYP3A4RAB9ANPC1SMN1; SMN2TP53
SCHEMBL2678487 0.78 ILK (0.56) CYP3A4RAB9ASMN1; SMN2TP53CYP1A2
SCHEMBL29741739 0.78 ILK (0.56) CYP3A4RAB9ASMN1; SMN2TP53CYP1A2

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-0788491-B1 6-POLYFLUOROALKOXY AND 6-POLYFLUOROALKYL-2-AMINOBENZOTHIAZOLE DERIVATIVES RHONE POULENC RORER SA (FR) 1999-12-01 EP disclosed
US-5795903-A 6-polyfluoroalkoxy-and 6-polyfluoroalkyl-2-aminobenzothiazole derivatives RHONE-POULENC RORER S.A. (FR) 1998-08-18 US disclosed
EP-0788491-A1 6-POLYFLUOROALKOXY AND 6-POLYFLUOROALKYL-2-AMINOBENZOTHIAZOLE DERIVATIVES Aventis Pharma S.A. (FR) 1997-08-13 EP disclosed
WO-1996013492-A1 6-POLYFLUOROALKOXY AND 6-POLYFLUOROALKYL-2-AMINOBENZOTHIAZOLE DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1996-05-09 WO disclosed