SCHEMBL2628773

SCHEMBL2628773

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)Nc1ccccc1I

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.58
EPHX1 P07099 1/20 0.48
P2RX4 Q99571 1/20 0.47
KCNA5 P22460 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
TRPV1 Q8NER1 4/20 0.41

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
SCHEMBL2628761 0.87 TRPM8 (0.58) TRPM8EPHX1P2RX4ALDH1A1HPGD
SCHEMBL4812089 0.87 P2RX4 (0.61) TRPM8EPHX1P2RX4KCNA5ALDH1A1
SCHEMBL5400523 0.87 TRPM8 (0.53) TRPM8EPHX1P2RX4KCNA5ALDH1A1
SCHEMBL2628771 0.86 TRPM8 (0.57) TRPM8EPHX1P2RX4ALDH1A1TRPV1
SCHEMBL4141645 0.85 TRPM8 (0.57) TRPM8EPHX1P2RX4KCNA5ALDH1A1
SCHEMBL4912015 0.85 TRPM8 (0.56) TRPM8EPHX1P2RX4KCNA5ALDH1A1
SCHEMBL28946956 0.85 TRPM8 (0.56) TRPM8EPHX1P2RX4ALDH1A1
SCHEMBL4883688 0.85 TRPM8 (0.56) TRPM8EPHX1P2RX4KCNA5ALDH1A1
SCHEMBL4820315 0.84 TRPM8 (0.55) TRPM8EPHX1P2RX4ALDH1A1
SCHEMBL4963208 0.84 TRPM8 (0.64) TRPM8EPHX1P2RX4

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-20130190296-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2013-07-25 US disclosed
US-20130190296-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2013-07-25 US disclosed
US-8389730-B2 Compositions and methods for the treatment of disease associated with TRP-P8 expression DENDREON CORPORATION (US) 2013-03-05 US disclosed
US-8389730-B2 Compositions and methods for the treatment of disease associated with TRP-P8 expression DENDREON CORPORATION (US) 2013-03-05 US disclosed
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2012-04-19 US disclosed
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2012-04-19 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-20130190296-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 10/4885EPHX1 2902/4885P2RX4 223/4885
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 8/4885EPHX1 2270/4885P2RX4 70/4885

“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.