SCHEMBL5403404

SCHEMBL5403404

Cc1cc(NC(=O)C2CC(C)CCC2C(C)C)ccc1I

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.63
EPHX1 P07099 1/20 0.44
GAA P10253 1/20 0.43
TRPV1 Q8NER1 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL2628739 0.89 TRPM8 (0.67) TRPM8EPHX1GAAALDH1A1MEN1
SCHEMBL14565718 0.89 TRPM8 (0.67) TRPM8EPHX1GAAALDH1A1MEN1
SCHEMBL10073199 0.86 TRPM8 (0.63) TRPM8EPHX1GAATRPV1ALDH1A1
SCHEMBL661540 0.86 TRPM8 (0.63) TRPM8EPHX1GAATRPV1ALDH1A1
SCHEMBL5448215 0.85 TRPM8 (0.64) TRPM8EPHX1GAATRPV1ALDH1A1
SCHEMBL19189293 0.84 TRPM8 (0.70) TRPM8EPHX1GAATRPV1ALDH1A1
SCHEMBL15131638 0.84 TRPM8 (0.63) TRPM8EPHX1ALDH1A1NPC1RAB9A
SCHEMBL2628755 0.84 TRPM8 (0.63) TRPM8EPHX1ALDH1A1NPC1RAB9A
SCHEMBL2628749 0.84 TRPM8 (0.63) TRPM8EPHX1GAATRPV1ALDH1A1
SCHEMBL4817319 0.83 TRPM8 (0.75) TRPM8EPHX1TRPV1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070053834-A1 Radioligands for the TRP-M8 receptor and methods therewith WEI EDWARD T 2007-03-08 US disclosed
US-7169377-B2 Radioligands for the TRP-M8 receptor and methods therewith WEI EDWARD T 2007-01-30 US disclosed
WO-2005039649-A1 RADIOLIGANDS FOR THE TRP-M8 RECEPTOR AND METHODS THEREWITH PAGET, HUGH, C., E. (GB) 2005-05-06 WO disclosed
US-20050084447-A1 Radioligands for the TRP-M8 receptor and methods therewith WEI EDWARD T (US) 2005-04-21 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 (2 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-20050084447-A1 Radioligands for the TRP-M8 receptor and methods therewith TRPM8, GPR68, OPRL1 TRPM8 1/4885EPHX1 4381/4885GAA 4871/4885
US-20070053834-A1 Radioligands for the TRP-M8 receptor and methods therewith GPR68, TRPM8, OPRL1 TRPM8 2/4885EPHX1 4778/4885GAA 4793/4885

“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.