SCHEMBL1033419

SCHEMBL1033419

CC1CN(C(=O)Nc2cnoc2)CC/C1=C\c1cccc(OCCc2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.40
PTPN1 P18031 4/20 0.39
AKR1B1 P15121 2/20 0.39
GPR55 Q9Y2T6 2/20 0.38
PTPN2 P17706 1/20 0.36
ACP1 P24666 1/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
GPR18 Q14330 1/20 0.35
GRIN2B Q13224 1/20 0.34
OGA O60502 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
SCHEMBL1033421 1.00 FAAH (0.40) FAAHPTPN1AKR1B1GPR55PTPN2
SCHEMBL1034795 0.94 F10 (0.40) FAAHPTPN1CYP3A4CYP2D6
SCHEMBL1034797 0.94 F10 (0.40) FAAHPTPN1CYP3A4CYP2D6
SCHEMBL1034929 0.93 OGA (0.39) FAAHGRIN2BOGA
SCHEMBL1034930 0.93 OGA (0.39) FAAHGRIN2BOGA
SCHEMBL1032417 0.93 CYP3A4 (0.40) FAAHCYP3A4CYP2D6
SCHEMBL1032416 0.93 CYP3A4 (0.40) FAAHCYP3A4CYP2D6
SCHEMBL1035402 0.93 F10 (0.41) FAAHCYP3A4CYP2D6
SCHEMBL1035400 0.93 F10 (0.41) FAAHCYP3A4CYP2D6
SCHEMBL1036100 0.91 CYP3A4 (0.36) FAAHAKR1B1GPR55CYP3A4CYP2D6

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 FAAH 1/4885PTPN1 3961/4885AKR1B1 581/4885

“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.