SCHEMBL6522805

SCHEMBL6522805

Cc1ncsc1CCOc1cccc(C=C2CCN(c3cnoc3)CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.40
OGA O60502 2/20 0.36
CYP4F2 P78329 3/20 0.36
CYP4A11 Q02928 3/20 0.36
GPR55 Q9Y2T6 2/20 0.33
GPR18 Q14330 2/20 0.33
GAA P10253 2/20 0.32
CHEK1 O14757 1/20 0.32
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KMT2A Q03164 1/20 0.31
PPARG P37231 1/20 0.31
GSK3B P49841 1/20 0.31

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
SCHEMBL6522876 0.84 HPGD (0.40) HPGDOGACYP4F2CYP4A11GPR55
SCHEMBL1036396 0.82 CYP3A4 (0.45) HPGDOGAGAAHTR2AKMT2A
SCHEMBL1075972 0.76 CYP3A4 (0.42) HPGDOGAGAAHTR2AKMT2A
SCHEMBL1037459 0.73 CYP3A4 (0.41) HPGDOGAGAAHTR2AALDH1A1
SCHEMBL1082548 0.72 FAAH (0.56) HPGDOGAGAAHTR2A
SCHEMBL6525248 0.72 HPGD (0.38) HPGDOGAALDH1A1MAPTMAPK1
SCHEMBL6518965 0.72 GPR18 (0.34) OGAGPR55GPR18
SCHEMBL6521424 0.67 GPR55 (0.37) OGAGPR55GPR18
SCHEMBL6521897 0.66 F10 (0.37) OGAGPR55HTR1APPARG
SCHEMBL1038304 0.66 CYP3A4 (0.49) OGAGAAHTR2AALDH1A1MAPT

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 1 patent. 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 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 HPGD 382/4885OGA 1857/4885CYP4F2 609/4885

“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.