SCHEMBL7548871

SCHEMBL7548871

COC(=O)Nc1ccc(OCc2nc3cccc(F)c3o2)cc1C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.44
RAB9A P51151 3/20 0.43
ALOX5 P09917 6/20 0.42
EPHX2 P34913 6/20 0.42
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HTT P42858 1/20 0.40
ALOX5AP P20292 1/20 0.39
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EGFR P00533 1/20 0.37
PPARD Q03181 1/20 0.37

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
SCHEMBL7542652 0.91 ALOX5 (0.43) KDRRAB9AALOX5EPHX2KMT2A
SCHEMBL7547406 0.91 KDR (0.46) KDRALOX5EPHX2KMT2AMEN1
SCHEMBL7544894 0.88 KDR (0.40) KDRRAB9AALOX5EPHX2KMT2A
SCHEMBL7543778 0.87 MAPT (0.45) KDRRAB9AALOX5EPHX2KMT2A
SCHEMBL7542905 0.85 SMN1; SMN2 (0.50) RAB9AKMT2AMEN1HTTALOX15
SCHEMBL7541413 0.84 LMNA (0.47) KDRRAB9AALOX5EPHX2KMT2A
SCHEMBL7542502 0.83 MAPT (0.46) KDRRAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7543749 0.82 ALOX5 (0.45) KDRALOX5EPHX2KMT2AMEN1
SCHEMBL7545106 0.81 CEPT1 (0.42) KDRRAB9AALOX5EPHX2EGFR
SCHEMBL7542077 0.81 CEPT1 (0.42) KDRALOX5EPHX2EGFR

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
EP-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 EP disclosed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 US disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 EP disclosed