SCHEMBL4556255

SCHEMBL4556255

COc1ccc(C(=O)Nc2ccc(C(C)(C)CNC(=O)c3ccc4c(cnn4CC(C)(C(N)=O)c4ccc(NC(=O)c5ccc(OC)c(OC)c5)cc4)c3)cc2)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.44
MAOA P21397 1/20 0.44
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ALDH1A1 P00352 2/20 0.41
PKM P14618 1/20 0.41
NPC1 O15118 4/20 0.40
POLB P06746 2/20 0.40
RAB9A P51151 3/20 0.40
ROCK2 O75116 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NQO2 P16083 1/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
TP53 P04637 1/20 0.39
PLAU P00749 1/20 0.39
LMNA P02545 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
SCHEMBL4555550 0.78 SMN1; SMN2 (0.60) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2813712 0.77 KMT2A (0.67) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2816819 0.77 MEN1 (0.63) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2815071 0.77 MEN1 (0.54) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2814955 0.76 ALDH1A1 (0.65) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2816590 0.75 LMNA (0.62) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL4556270 0.75 MEN1 (0.45) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2819556 0.75 MEN1 (0.56) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2815527 0.75 MEN1 (0.56) KMT2AMEN1ALDH1A1PKMNPC1
SCHEMBL2820235 0.75 TSHR (0.59) KMT2AMEN1ALDH1A1PKMPOLB

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