SCHEMBL2628752

SCHEMBL2628752

CC(=O)c1cccc(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.61
ALDH1A1 P00352 1/20 0.53
NPC1 O15118 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
EPHX1 P07099 1/20 0.48
TRPV1 Q8NER1 1/20 0.47
PARP1 P09874 1/20 0.45
PARP10 Q53GL7 1/20 0.45
PKM P14618 1/20 0.45
ALOX15 P16050 1/20 0.45
APEX1 P27695 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EPHX2 P34913 2/20 0.44

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
SCHEMBL299356 0.91 TRPM8 (0.58) TRPM8ALDH1A1EPHX1TRPV1PARP1
SCHEMBL2628779 0.91 TRPM8 (0.58) TRPM8ALDH1A1EPHX1TRPV1PARP1
SCHEMBL2628762 0.89 TRPM8 (0.62) TRPM8ALDH1A1EPHX1TRPV1SMN1; SMN2
SCHEMBL15133466 0.87 TRPM8 (0.62) TRPM8ALDH1A1NPC1EPHX1TRPV1
SCHEMBL2628616 0.86 TRPM8 (0.72) TRPM8ALDH1A1NPC1EPHX1TRPV1
SCHEMBL369792 0.86 TRPM8 (0.72) TRPM8ALDH1A1NPC1EPHX1TRPV1
SCHEMBL10072944 0.86 TRPM8 (0.61) TRPM8ALDH1A1NPC1TDP1EPHX1
SCHEMBL10073491 0.85 TRPM8 (0.73) TRPM8NPC1TDP1EPHX1SMN1; SMN2
SCHEMBL4817890 0.85 TRPM8 (0.73) TRPM8NPC1TDP1EPHX1SMN1; SMN2
SCHEMBL4143429 0.85 TRPM8 (0.60) TRPM8EPHX1TRPV1

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-8362264-B2 Tryptophan antagonist; anticancer agents DENDREON CORPORATION (US) 2013-01-29 US disclosed
US-8362264-B2 Tryptophan antagonist; anticancer agents DENDREON CORPORATION (US) 2013-01-29 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 10/4885ALDH1A1 4716/4885NPC1 1445/4885
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 8/4885ALDH1A1 4742/4885NPC1 985/4885

“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.