SCHEMBL1037092

SCHEMBL1037092

Cc1oncc1NC(=O)N1CC/C(=C\c2cccc(OCCc3ccccc3)c2)C(C)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.39
AKR1B1 P15121 2/20 0.39
GPR55 Q9Y2T6 2/20 0.38
FAAH O00519 3/20 0.36
PTPN2 P17706 1/20 0.36
ACP1 P24666 1/20 0.36
GPR18 Q14330 1/20 0.35
PPARG P37231 8/20 0.34
PPARA Q07869 8/20 0.34
OGA O60502 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL1037095 1.00 PTPN1 (0.39) PTPN1AKR1B1GPR55FAAHPTPN2
SCHEMBL1035734 0.94 F10 (0.39) PTPN1FAAHOGACYP3A4CYP2D6
SCHEMBL1035732 0.94 F10 (0.39) PTPN1FAAHOGACYP3A4CYP2D6
SCHEMBL1035490 0.93 OGA (0.39) FAAHOGA
SCHEMBL1035491 0.93 OGA (0.39) FAAHOGA
SCHEMBL1036404 0.93 F10 (0.40) FAAHPPARGPPARAOGACYP3A4
SCHEMBL1036398 0.93 CYP3A4 (0.38) FAAHOGACYP3A4CYP2D6
SCHEMBL1036400 0.93 CYP3A4 (0.38) FAAHOGACYP3A4CYP2D6
SCHEMBL1036405 0.93 F10 (0.40) FAAHPPARGPPARAOGACYP3A4
SCHEMBL1032076 0.91 OGA (0.34) PTPN1AKR1B1GPR55FAAHPTPN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053982-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2011-03-03 US claimed
EP-2276738-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP claimed
WO-2009127943-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO claimed
US-20110053982-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2011-03-03 US disclosed
EP-2276738-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
WO-2009127943-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 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-20110053982-A1 ETHER BENZYLIDENE PIPERIDINE 5-MEMBERED ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS FAAH, FAAH2, CNR2 PTPN1 3961/4885AKR1B1 581/4885GPR55 65/4885

“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.