SCHEMBL1037381

SCHEMBL1037381

Cc1cccc(OCCOc2cccc(/C=C3\CCN(C(=O)Nc4cnoc4)CC3C)c2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2D6 P10635 3/20 0.38
ALDH1A1 P00352 5/20 0.38
GAA P10253 2/20 0.38
MAPK1 P28482 2/20 0.38
GFER P55789 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
CYP2C19 P33261 1/20 0.37
GSK3B P49841 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
OGA O60502 1/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
FAAH O00519 2/20 0.34
NPC1 O15118 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
SCHEMBL1037382 1.00 MAPT (0.38) MAPTTSHRCYP3A4CYP2D6ALDH1A1
SCHEMBL1035612 0.91 FAAH (0.38) MAPTTSHRCYP3A4CYP2D6MEN1
SCHEMBL1035611 0.91 FAAH (0.38) MAPTTSHRCYP3A4CYP2D6MEN1
SCHEMBL1033612 0.91 CYP3A4 (0.36) CYP3A4CYP2D6ALDH1A1GAAMAPK1
SCHEMBL1033614 0.91 CYP3A4 (0.36) CYP3A4CYP2D6ALDH1A1GAAMAPK1
SCHEMBL1037041 0.91 GALR3 (0.38) MAPTCYP3A4CYP2D6MEN1KMT2A
SCHEMBL1037043 0.91 GALR3 (0.38) MAPTCYP3A4CYP2D6MEN1KMT2A
SCHEMBL1035342 0.90 CYP3A4 (0.38) CYP3A4CYP2D6OGAFAAH
SCHEMBL1035341 0.90 CYP3A4 (0.38) CYP3A4CYP2D6OGAFAAH
SCHEMBL1033419 0.89 FAAH (0.40) CYP3A4CYP2D6OGAFAAH

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 MAPT 3493/4885TSHR 2147/4885CYP3A4 524/4885

“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.