SCHEMBL6176233

SCHEMBL6176233

O/N=C\c1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 5/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
POLB P06746 1/20 0.50
NPC1 O15118 6/20 0.48
RAB9A P51151 6/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
NPSR1 Q6W5P4 3/20 0.42
PKM P14618 1/20 0.42
PLAU P00749 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
XBP1 P17861 1/20 0.40
OPRK1 P41145 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL6176241 1.00 ALDH1A1 (0.50) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL30525118 1.00 ALDH1A1 (0.50) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL30525114 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6177462 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6178717 0.81 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL24485240 0.79 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL29055160 0.79 ALDH1A1 (0.43) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6176174 0.78 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL7766969 0.77 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2POLBNPC1
SCHEMBL6177938 0.76 ALDH1A1 (0.59) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708756-B1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AG (DE) 2005-06-01 EP disclosed
US-5783522-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed
EP-0708756-A1 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1996-05-01 EP disclosed
WO-1995002580-A2 SUBSTITUTED 2-PHENYLPYRIDINES WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1995-01-26 WO disclosed