SCHEMBL8545370

SCHEMBL8545370

N#Cc1ccc(-c2ncc(C(F)(F)F)cc2Cl)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.55
KDM4E B2RXH2 3/20 0.55
SMN1; SMN2 Q16637 4/20 0.50
POLB P06746 1/20 0.50
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
HTT P42858 2/20 0.48
MAPT P10636 1/20 0.48
MAPK1 P28482 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
PKM P14618 2/20 0.44
CYP11B2 P19099 2/20 0.43
CYP11B1 P15538 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
AR P10275 3/20 0.40
GAA P10253 1/20 0.39
MEN1 O00255 1/20 0.39
STAT3 P40763 1/20 0.39
STAT1 P42224 1/20 0.39
CASP3 P42574 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
SCHEMBL6176491 0.85 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL10757128 0.84 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6176174 0.84 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL11558383 0.82 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL8548969 0.81 ALDH1A1 (0.52) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL9727631 0.80 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL2149591 0.80 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6176381 0.80 ALDH1A1 (0.50) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL10963741 0.79 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL8546136 0.78 ALDH1A1 (0.46) ALDH1A1KDM4ESMN1; SMN2POLBNPC1

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-0802903-B1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AG (DE) 1998-09-09 EP disclosed
US-5747422-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-05-05 US disclosed
CN-1168135-A Substituted 2-phenylpyridines BASF AG (DE) 1997-12-17 CN disclosed
EP-0802903-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-10-29 EP disclosed
WO-1996021646-A1 SUBSTITUTED 2-PHENYLPYRIDINES AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed