SCHEMBL4440528

SCHEMBL4440528

COc1ccc(C(=O)Nc2ccc(C(C)(C)CNC(=O)c3nn(-c4ccccc4)nc3C)cc2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
POLB P06746 2/20 0.50
HDAC1 Q13547 2/20 0.48
ABCG2 Q9UNQ0 2/20 0.47
LMNA P02545 2/20 0.45
PKM P14618 2/20 0.45
NPC1 O15118 2/20 0.45
USP2 O75604 2/20 0.45
RAB9A P51151 2/20 0.45
ALDH1A1 P00352 2/20 0.45
NQO2 P16083 1/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KDM4E B2RXH2 1/20 0.44
NAMPT P43490 1/20 0.44

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
SCHEMBL27775928 0.89 MAPT (0.53) MAPTMEN1KMT2APOLBABCG2
SCHEMBL2816819 0.84 MEN1 (0.63) MAPTMEN1KMT2APOLBPKM
SCHEMBL2817833 0.81 MEN1 (0.48) MAPTMEN1KMT2APOLBPKM
SCHEMBL2815122 0.80 KMT2A (0.57) MAPTMEN1KMT2APOLBLMNA
SCHEMBL2814575 0.79 NPC1 (0.51) MAPTMEN1KMT2APOLBLMNA
SCHEMBL2813712 0.79 KMT2A (0.67) MAPTMEN1KMT2APOLBLMNA
SCHEMBL2815071 0.78 MEN1 (0.54) MAPTMEN1KMT2APKMNPC1
SCHEMBL4555728 0.78 FLT3 (0.55) MEN1KMT2ALMNANPC1ALDH1A1
SCHEMBL2819556 0.78 MEN1 (0.56) MAPTMEN1KMT2APOLBPKM
SCHEMBL2815527 0.78 MEN1 (0.56) MAPTMEN1KMT2APOLBPKM

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-2134676-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE Addex Pharma SA (CH) 2009-12-23 EP disclosed
WO-2008117175-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2008-10-02 WO disclosed