SCHEMBL7997383

SCHEMBL7997383

CC(C)n1c(=O)[nH]c2cc(-c3ncc(C(F)(F)F)cc3Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 7/20 0.47
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ POLB P06746 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ B3GNT2 Q9NY97 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RXFP1 Q9HBX9 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
SCHEMBL8008014 0.82 MAPK14 (0.50) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL9033850 0.82 B3GNT2 (0.46) PGRALDH1A1SMN1; SMN2POLBKDM4E
SCHEMBL7178381 0.76 ALDH1A1 (0.69) PGRALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL27432293 0.75 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL8009664 0.74 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL8007279 0.74 NPC1 (0.39) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL8009751 0.73 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL8009560 0.73 GRIN1 (0.40) ALDH1A1SMN1; SMN2POLBKDM4ENPC1
SCHEMBL8009389 0.71 GRIN1 (0.49) ALDH1A1SMN1; SMN2POLBKDM4EHTT
SCHEMBL9033846 0.71 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2POLBKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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