SCHEMBL1034577

SCHEMBL1034577

Cc1onc(NC(=O)N2CC/C(=C\c3ccc(F)cc3)C(C)C2)c1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.48
MAPT P10636 2/20 0.36
MAPK1 P28482 2/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
OGA O60502 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
POLB P06746 1/20 0.33
PAX8 Q06710 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL1034578 1.00 FAAH (0.48) FAAHMAPTMAPK1LMNATSHR
SCHEMBL1035246 0.90 FAAH (0.39) FAAHMAPTLMNARAB9ANPC1
SCHEMBL1035244 0.90 FAAH (0.39) FAAHMAPTLMNARAB9ANPC1
SCHEMBL1036647 0.90 FAAH (0.43) FAAHMAPTRAB9APOLB
SCHEMBL1036646 0.90 FAAH (0.43) FAAHMAPTRAB9APOLB
SCHEMBL1033513 0.89 FAAH (0.49) FAAHLMNARAB9ACYP1A2CYP3A4
SCHEMBL1031991 0.89 FAAH (0.41) FAAHMAPTLMNATSHRPOLB
SCHEMBL1033511 0.89 FAAH (0.49) FAAHLMNARAB9ACYP1A2CYP3A4
SCHEMBL1031992 0.89 FAAH (0.41) FAAHMAPTLMNATSHRPOLB
SCHEMBL1035614 0.88 FAAH (0.40) FAAHMAPTMAPK1RAB9ANPC1

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 FAAH 1/4885MAPT 4388/4885MAPK1 1712/4885

“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.