SCHEMBL8433950

SCHEMBL8433950

Nc1nc2cc(O)c(OC(F)(F)F)cc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
CYP3A4 P08684 4/20 0.56
TP53 P04637 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
SCN4A P35499 3/20 0.56
HSD17B10 Q99714 3/20 0.56
GAA P10253 2/20 0.56
CYP1A2 P05177 2/20 0.56
LMNA P02545 2/20 0.56
PKM P14618 2/20 0.56
GMNN O75496 1/20 0.56
USP2 O75604 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
CYP2C9 P11712 1/20 0.56
ALOX15 P16050 1/20 0.56
NFKB1 P19838 1/20 0.56
SLC6A2 P23975 1/20 0.56
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56

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
SCHEMBL9474730 0.84 RAB9A (0.59) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL16276940 0.82 RAB9A (0.56) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL8435128 0.81 CYP3A4 (0.55) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL5707550 0.80 CYP3A4 (0.53) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL17610032 0.79 RAB9A (0.56) RAB9ANPC1CYP3A4TP53SMN1; SMN2
Hydrochloric Acid SCHEMBL5707606 0.78 CYP3A4 (0.51) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL9474307 0.76 GAA (0.56) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL18201946 0.76 GAA (0.60) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL480862 0.72 RAB9A (0.77) RAB9ANPC1CYP3A4TP53SMN1; SMN2
SCHEMBL31132377 0.72 RAB9A (0.77) RAB9ANPC1CYP3A4TP53SMN1; SMN2

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