SCHEMBL1345987

SCHEMBL1345987

CN(Cc1ccc(-c2cccc(C(N)=O)c2)cc1)C1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.62
HRH4 Q9H3N8 1/20 0.62
TRPV1 Q8NER1 2/20 0.48
MGLL Q99685 2/20 0.48
FAAH O00519 1/20 0.46
TRPA1 O75762 1/20 0.46
EPHX2 P34913 1/20 0.46
FAAH2 Q6GMR7 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
AOC3 Q16853 2/20 0.46
HDAC1 Q13547 1/20 0.43
NAAA Q02083 1/20 0.43
ERN1 O75460 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL19444786 0.86 HRH3 (0.50) HRH3HRH4AOC3OPRM1OPRD1
SCHEMBL3090217 0.83 HRH3 (0.64) HRH3HRH4
Hydrochloric Acid SCHEMBL28918864 0.82 HRH3 (0.62) HRH3HRH4
SCHEMBL1348558 0.82 BCHE (0.44) TRPV1MGLLFAAHTRPA1EPHX2
SCHEMBL1787319 0.81 PPARG (0.48) TRPV1MGLLFAAHTRPA1EPHX2
SCHEMBL13148493 0.81 CCR2 (0.57) HRH3HRH4HDAC1MEN1KMT2A
SCHEMBL12651155 0.78 HRH3 (0.60) HRH3MGLLFAAHTRPA1EPHX2
SCHEMBL12651383 0.78 HRH3 (0.60) HRH3MGLLFAAHTRPA1EPHX2
SCHEMBL1347706 0.78 HRH3 (0.60) HRH3MGLLFAAHTRPA1EPHX2
SCHEMBL15633633 0.75 UBE2M (0.42) TRPV1MGLLAOC3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8063247-B2 Bicyclic aryl and heteroaryl receptor modulators PROSIDION LIMITED (GB) 2011-11-22 US disclosed
US-20100267780-A1 BICYCLIC ARYL AND HETEROARYL RECEPTOR MODULATORS PROSIDION LIMITED (GB) 2010-10-21 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-20100267780-A1 BICYCLIC ARYL AND HETEROARYL RECEPTOR MODULATORS OPRM1, OPRL1, OPRD1 HRH3 703/4885HRH4 419/4885TRPV1 132/4885

“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.