SCHEMBL2817833

SCHEMBL2817833

COc1ccc(C(=O)Nc2ccc(C(C)(C)CNC(=O)c3nn(C)cc3-c3ccccc3)cc2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPT P10636 5/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 1/20 0.43
NQO2 P16083 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
ROCK2 O75116 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
NAMPT P43490 1/20 0.43
MCHR1 Q99705 2/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
NR1H4 Q96RI1 1/20 0.42

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
SCHEMBL28782820 0.89 MEN1 (0.49) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2814575 0.86 NPC1 (0.51) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2816819 0.83 MEN1 (0.63) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL4440528 0.81 MAPT (0.50) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2815122 0.78 KMT2A (0.57) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2813712 0.77 KMT2A (0.67) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2815071 0.77 MEN1 (0.54) MEN1KMT2AMAPTNPC1NQO2
SCHEMBL4555728 0.77 FLT3 (0.55) MEN1KMT2ANPC1KDM4EALDH1A1
SCHEMBL2819556 0.77 MEN1 (0.56) MEN1KMT2AMAPTPOLBNPC1
SCHEMBL2815527 0.77 MEN1 (0.56) MEN1KMT2AMAPTPOLBNPC1

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
US-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2010-09-30 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE FSHR, GNRHR, SHBG MEN1 150/4885KMT2A 1767/4885MAPT 4813/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.