SCHEMBL1035386

SCHEMBL1035386

Cc1cc(/C=C2\CCN(C(=O)Nc3onc(C)c3C)CC2C)ccc1F

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.34
MAPT P10636 2/20 0.33
P2RY1 P47900 1/20 0.33
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EPHX2 P34913 1/20 0.31
TP53 P04637 1/20 0.31
CASR P41180 1/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KCNJ1 P48048 3/20 0.30
EDNRA P25101 1/20 0.30

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
SCHEMBL1035388 1.00 ENPP2 (0.34) ENPP2MAPTP2RY1POLBMEN1
SCHEMBL1033606 0.94 ENPP2 (0.34) ENPP2MAPTP2RY1POLBMEN1
SCHEMBL1033608 0.94 ENPP2 (0.34) ENPP2MAPTP2RY1POLBMEN1
SCHEMBL1032058 0.91 P2RY1 (0.41) ENPP2MAPTP2RY1MEN1KMT2A
SCHEMBL1032056 0.91 P2RY1 (0.41) ENPP2MAPTP2RY1MEN1KMT2A
SCHEMBL1035033 0.90 P2RX7 (0.33) ENPP2MAPTP2RY1TP53
SCHEMBL1035034 0.90 P2RX7 (0.33) ENPP2MAPTP2RY1TP53
SCHEMBL1033260 0.89 EDNRB (0.37) ENPP2MAPTPOLBMEN1KMT2A
SCHEMBL1033259 0.89 EDNRB (0.37) ENPP2MAPTPOLBMEN1KMT2A
SCHEMBL1036470 0.88 CYP3A4 (0.36) ENPP2MAPTKMT2ATP53CASR

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
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 43/4885MAPT 4388/4885P2RY1 448/4885

“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.