SCHEMBL2815480

SCHEMBL2815480

COc1ccc(C(=O)Nc2ccc(C(C)(C)CNC(=O)c3n[nH]c4ccccc34)c(C)c2)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.53
NTRK2 Q16620 1/20 0.53
FLT3 P36888 9/20 0.49
RAC1 P63000 1/20 0.49
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CDK2 P24941 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
MAP4K1 Q92918 1/20 0.46
NQO2 P16083 1/20 0.45
CASP3 P42574 1/20 0.45
RAB9A P51151 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
CSNK2A1 P68400 1/20 0.45

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
SCHEMBL2818030 0.91 NTRK1 (0.52) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL27776067 0.89 NTRK1 (0.61) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL4555728 0.88 FLT3 (0.55) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL4555775 0.87 NTRK1 (0.51) NTRK1NTRK2FLT3RAC1NPC1
SCHEMBL2819888 0.87 FLT3 (0.54) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL4555774 0.84 NTRK1 (0.51) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL2818047 0.83 LCK (0.45) KDM4ENPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL27775961 0.80 NTRK1 (0.60) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL27796823 0.79 NTRK1 (0.62) NTRK1NTRK2FLT3RAC1KDM4E
SCHEMBL2816744 0.78 ROCK1 (0.49) NTRK1FLT3NPC1ALDH1A1CDK2

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-2134676-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE Addex Pharma SA (CH) 2009-12-23 EP claimed
WO-2008117175-A2 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2008-10-02 WO claimed
US-20100249123-A1 NOVEL BENZAMIDE DERIVATIVES AS MODULATORS OF THE FOLLICLE STIMULATING HORMONE ADDEX PHARMA SA (CH) 2010-09-30 US 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 NTRK1 2016/4885NTRK2 630/4885FLT3 551/4885

“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.