SCHEMBL6522943

SCHEMBL6522943

Cc1noc(N2CCC(=Cc3cccc(OCCC(C)C)c3)CC2)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 2/20 0.35
GALR3 O60755 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 5/20 0.32
GPR18 Q14330 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
MCL1 Q07820 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
MEN1 O00255 4/20 0.32
POLB P06746 4/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
GSK3B P49841 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
MAPK1 P28482 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 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
SCHEMBL6520847 0.90 OGA (0.35) OGAKMT2AGPR18GPR55NPC1
SCHEMBL6519237 0.88 TLR4 (0.39) OGAKMT2AGPR18NPSR1GPR55
SCHEMBL6522747 0.86 OGA (0.35) OGAGPR18GPR55NPC1RAB9A
SCHEMBL6517979 0.85 CYP2D6 (0.35) OGAGPR18GPR55
SCHEMBL6519327 0.84 GPR55 (0.37) OGAGPR18GPR55POLBTDP1
SCHEMBL6517028 0.84 OGA (0.35) OGALMNA
SCHEMBL6525594 0.83 F10 (0.37) OGAGPR18GPR55POLBTDP1
SCHEMBL6516955 0.83 CYP3A4 (0.33) OGA
SCHEMBL6522748 0.82 TLR4 (0.41) OGA
SCHEMBL6518965 0.81 GPR18 (0.34) OGAGPR18GPR55

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 OGA 1857/4885GALR3 761/4885HSP90AA1 1659/4885

“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.