SCHEMBL1035832

SCHEMBL1035832

Cc1ccc(NC(=O)N2CCC(=Cc3cccc(OCCc4ccccc4)c3)C(C)C2)cn1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
FAAH O00519 8/20 0.40
PTPN1 P18031 3/20 0.39
AKR1B1 P15121 2/20 0.39
GPR55 Q9Y2T6 1/20 0.39
F10 P00742 2/20 0.38
RAB9A P51151 1/20 0.38
PTPN2 P17706 1/20 0.37
ACP1 P24666 1/20 0.37
GRIN2B Q13224 1/20 0.37

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
SCHEMBL1035831 1.00 CYP3A4 (0.49) CYP3A4CYP2D6FAAHPTPN1AKR1B1
SCHEMBL1076930 0.95 CYP3A4 (0.50) CYP3A4CYP2D6FAAHF10
SCHEMBL1076929 0.95 CYP3A4 (0.50) CYP3A4CYP2D6FAAHF10
SCHEMBL1038379 0.93 CYP3A4 (0.47) CYP3A4CYP2D6FAAHF10
SCHEMBL1038380 0.93 CYP3A4 (0.47) CYP3A4CYP2D6FAAHF10
SCHEMBL1038632 0.93 CYP3A4 (0.47) CYP3A4CYP2D6FAAHF10RAB9A
SCHEMBL1038631 0.93 CYP3A4 (0.47) CYP3A4CYP2D6FAAHF10RAB9A
SCHEMBL1035911 0.93 CYP3A4 (0.48) CYP3A4CYP2D6FAAHF10
SCHEMBL1035909 0.93 CYP3A4 (0.48) CYP3A4CYP2D6FAAHF10
SCHEMBL1037912 0.91 CYP3A4 (0.44) CYP3A4CYP2D6FAAHPTPN1AKR1B1

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
US-20110144159-A1 ETHER BENZYLIDENE PIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC 2011-06-16 US disclosed
EP-2276735-A1 ETHER BENZYLIDENE PIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
WO-2009127944-A1 ETHER BENZYLIDENE PIPERIDINE 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-20110144159-A1 ETHER BENZYLIDENE PIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS FAAH, FAAH2, PAH CYP3A4 329/4885CYP2D6 382/4885FAAH 1/4885

“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.