SCHEMBL2816192

SCHEMBL2816192

CC(C)(C#N)c1ccc(N)cc1-c1cccnc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.45
MEN1 O00255 1/20 0.45
PSIP1 O75475 1/20 0.45
MKNK1 Q9BUB5 1/20 0.45
MKNK2 Q9HBH9 1/20 0.45
KDM4E B2RXH2 7/20 0.43
GLA P06280 3/20 0.43
GAA P10253 2/20 0.43
HTT P42858 2/20 0.42
MAPT P10636 1/20 0.42
CYP11B2 P19099 2/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CFTR P13569 1/20 0.41
RXFP1 Q9HBX9 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
IKBKB O14920 1/20 0.40
TDO2 P48775 1/20 0.39
KIF11 P52732 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL7086251 0.84 AXL (0.51) AXLMEN1PSIP1MKNK1MKNK2
SCHEMBL2816692 0.83 ALDH1A1 (0.38) MEN1KDM4EGLAGAAHTT
SCHEMBL2817404 0.79 RAB9A (0.47) MEN1KDM4EHTTMAPTCYP11B2
SCHEMBL2816297 0.76 ADORA2A (0.37) MEN1KDM4EGAAHTTMAPT
SCHEMBL2817047 0.75 IMPDH2 (0.46) MEN1KDM4EGAAMAPTTDO2
SCHEMBL2817377 0.75 AXL (0.46) AXLPIK3CA
SCHEMBL2815579 0.74 KDM4E (0.40) MEN1KDM4EGLAGAAMAPT
SCHEMBL16405695 0.74 AXL (0.61) AXLMEN1PSIP1MKNK1MKNK2
SCHEMBL30714540 0.73 AXL (0.56) AXLMEN1PSIP1MKNK1MKNK2
SCHEMBL1439800 0.73 AXL (0.56) AXLMEN1PSIP1MKNK1MKNK2

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 4 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
CN-101679215-A New benzamide derivatives as the follicle stimulating hormone conditioning agent ADDEX PHARMA SA 2010-03-24 CN 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 AXL 1017/4885MEN1 150/4885PSIP1 4078/4885

“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.