SCHEMBL6967259

SCHEMBL6967259

O=[N+]([O-])c1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 1/20 0.48
SMN1; SMN2 Q16637 6/20 0.48
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 3/20 0.48
POLB P06746 2/20 0.48
MAPT P10636 7/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
HTT P42858 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 2/20 0.46
CYP3A4 P08684 2/20 0.46
CASP3 P42574 2/20 0.46
SENP8 Q96LD8 2/20 0.46
SENP7 Q9BQF6 2/20 0.46
SENP6 Q9GZR1 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46

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
SCHEMBL6177707 0.89 SMN1; SMN2 (0.51) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL6176987 0.86 FGFR4 (0.49) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL8008037 0.85 SMN1; SMN2 (0.54) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL6176381 0.82 ALDH1A1 (0.50) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL8007429 0.82 CYP1A2 (0.46) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL10757128 0.82 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1KDM4EPOLBMAPT
SCHEMBL11558383 0.80 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1KDM4EPOLBMAPT
SCHEMBL7997471 0.80 MAPT (0.50) FGFR4SMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL10963741 0.79 ALDH1A1 (0.55) SMN1; SMN2ALDH1A1KDM4EPOLBMAPT
SCHEMBL6176174 0.79 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1KDM4EPOLBMAPT

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-0708769-B1 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITY BASF AG (DE) 2003-01-29 EP disclosed
US-6165941-A Substituted 2-phenylpyridines BASF AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
EP-0708769-A1 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITY BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 EP disclosed
WO-1995002590-A2 SUBSTITUTED 2-FUSED PHENYLPYRIDINES WITH HERBICIDAL ACTIVITIES BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 WO disclosed
EP-0479420-A2 Benzoxazine derivative and herbicide containing same as an active ingredient SUNTORY LIMITED (JP) 1992-04-08 EP disclosed