SCHEMBL3589972

SCHEMBL3589972

COc1cc(F)ccc1CCN1CCC(N(C)C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 3/20 0.50
OPRM1 P35372 2/20 0.47
CACNA1G O43497 1/20 0.45
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
HTR2A P28223 1/20 0.44
GRM2 Q14416 1/20 0.44

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
SCHEMBL3589971 0.81 CACNA1G (0.48) CACNA1G
SCHEMBL5709455 0.79 CACNA1G (0.46) CACNA1GSIGMAR1HTR2AGRM2
SCHEMBL2975084 0.78 CACNA1G (0.41) CACNA1G
SCHEMBL2975087 0.76 CACNA1G (0.41) CCR5OPRM1CACNA1GTMEM97SIGMAR1
SCHEMBL3593975 0.76 CCR5 (0.60) CCR5SIGMAR1
SCHEMBL2975081 0.74 CACNA1G (0.43) CACNA1GTMEM97HTR2AGRM2
SCHEMBL13037096 0.72 CACNA1G (0.43) CACNA1G
SCHEMBL3589417 0.72 ALDH1A1 (0.52) CCR5SIGMAR1GRM2
SCHEMBL3938943 0.71 OPRM1 (0.50) CCR5OPRM1SIGMAR1
SCHEMBL3604727 0.71 C5AR1 (0.60) CCR5OPRM1SIGMAR1

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-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP claimed
US-20100279998-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS SANOFI-AVENTIS (FR) 2010-11-04 US disclosed
EP-1720550-B1 DERIVATIVES OF PIPERIDINYLALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-04-15 EP 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-20100279998-A1 PIPERIDINYLALKYLCARBAMATE DERIVATIVES, METHODS FOR THEIR PREPARATION AND THE THERAPEUTIC USE THEREOF AS FATTY ACID AMIDO HYDROLASE ENZYME INHIBITORS FAAH, FAAH2, CNR2 CCR5 1522/4885OPRM1 782/4885CACNA1G 1115/4885

“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.