SCHEMBL1036172

SCHEMBL1036172

Cc1noc(NC(=O)N2CC/C(=C\c3ccc(Cl)cc3)C(C)C2)c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 3/20 0.38
EDNRA P25101 3/20 0.37
EDNRB P24530 2/20 0.37
ALDH1A1 P00352 1/20 0.37
ATM Q13315 1/20 0.37
LMNA P02545 3/20 0.34
EPHX2 P34913 1/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
P2RY1 P47900 1/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CASR P41180 1/20 0.33
NPC1 O15118 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
POLB P06746 1/20 0.32
USP2 O75604 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL1036174 1.00 ENPP2 (0.38) ENPP2EDNRAEDNRBALDH1A1ATM
SCHEMBL1033260 0.90 EDNRB (0.37) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1033259 0.90 EDNRB (0.37) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1033287 0.90 MAPT (0.38) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1033289 0.90 MAPT (0.38) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1032058 0.89 P2RY1 (0.41) ENPP2MAPTP2RY1SMN1; SMN2
SCHEMBL1032056 0.89 P2RY1 (0.41) ENPP2MAPTP2RY1SMN1; SMN2
SCHEMBL1031090 0.89 EDNRB (0.39) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1031089 0.89 EDNRB (0.39) ENPP2EDNRAEDNRBALDH1A1LMNA
SCHEMBL1033606 0.88 ENPP2 (0.34) ENPP2EDNRAEPHX2TP53MAPT

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-20110053950-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER, INC. 2011-03-03 US claimed
EP-2276734-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP claimed
WO-2009127946-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO claimed
US-20110053950-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER, INC. 2011-03-03 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-20110053950-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS FAAH, FAAH2, CNR2 ENPP2 43/4885EDNRA 2234/4885EDNRB 2169/4885

“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.