SCHEMBL2817441

SCHEMBL2817441

CN(C)CCCn1cc(C(=O)O)c2cc(F)ccc21

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.51
CNR2 P34972 4/20 0.50
CNR1 P21554 1/20 0.50
KDM4C Q9H3R0 2/20 0.47
ICMT O60725 2/20 0.46
HTR3A P46098 5/20 0.44
SCN9A Q15858 1/20 0.43
MPO P05164 2/20 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
SCHEMBL4494230 0.86 CNR2 (0.61) CNR2CNR1KDM4CICMTHTR3A
SCHEMBL2816604 0.84 CNR2 (0.51) CNR2CNR1KDM4CICMTHTR3A
SCHEMBL25403772 0.82 CNR1 (0.50) CNR2CNR1KDM4CICMTHTR3A
SCHEMBL31083818 0.82 CNR1 (0.50) CNR2CNR1KDM4CICMTHTR3A
SCHEMBL12485447 0.80 KDM4E (0.54) CNR2CNR1KDM4CHTR3A
SCHEMBL2817707 0.80 ALDH1A1 (0.50) CNR2CNR1KDM4CHTR3A
SCHEMBL27335551 0.78 CNR2 (0.55) CNR2CNR1KDM4CICMT
SCHEMBL15557151 0.76 HTR3A (0.58) CNR2CNR1KDM4CHTR3A
SCHEMBL6590622 0.75 CNR2 (0.48) CNR2CNR1ICMTHTR3A
SCHEMBL2433258 0.75 KDM4E (0.55) KDM4C

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 claimed
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 HTR6 797/4885CNR2 198/4885CNR1 90/4885

“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.