SCHEMBL8522744

SCHEMBL8522744

CCc1cc(C(F)(F)F)cc(C(=O)Nc2cccc3c2CCN(C)C3)c1OC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPY5R Q15761 1/20 0.40
KLKB1 P03952 1/20 0.40
RXFP1 Q9HBX9 4/20 0.38
PTGES O14684 1/20 0.37
KIT P10721 1/20 0.37
HTR1F P30939 1/20 0.37
CARM1 Q86X55 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
NTRK3 Q16288 1/20 0.36

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
SCHEMBL8182722 0.82 KDR (0.43) KDRMEN1KMT2AKLKB1PTGES
SCHEMBL8184224 0.79 MEN1 (0.44) KDRMEN1KMT2AKLKB1RXFP1
SCHEMBL8068248 0.78 MEN1 (0.43) KDRMEN1KMT2AKLKB1RXFP1
SCHEMBL7792082 0.77 MEN1 (0.42) KDRMEN1KMT2ARXFP1PTGES
SCHEMBL7799989 0.77 ALDH1A1 (0.44) KDRMEN1KMT2A
SCHEMBL8184203 0.77 KMT2A (0.42) MEN1KMT2ARXFP1
SCHEMBL8184226 0.77 KMT2A (0.46) KDRMEN1KMT2APPARGPPARD
SCHEMBL8174302 0.77 KMT2A (0.46) MEN1KMT2A
SCHEMBL8176105 0.76 MEN1 (0.44) KDRMEN1KMT2ANPY5RKLKB1
SCHEMBL8604955 0.76 HTR1F (0.46) MEN1KMT2AHTR1FCARM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906283-A1 SUBSTITUTED BENZAMIDE DERIVATIVES AND THEIR USE AS ANTICONVULSANTS SMITHKLINE BEECHAM PLC (GB) 1999-04-07 EP disclosed
WO-1997048683-A1 SUBSTITUTED BENZAMIDE DERIVATIVES AND THEIR USE AS ANTICONVULSANTS SMITHKLINE BEECHAM PLC (GB) 1997-12-24 WO disclosed