SCHEMBL2628639

SCHEMBL2628639

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)Nc1ccc2c(c1)CCC2=O

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.59
BAZ2B Q9UIF8 1/20 0.44
MAPK14 Q16539 3/20 0.44
EPHX1 P07099 1/20 0.41
TRPV1 Q8NER1 3/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL663303 0.83 TRPM8 (0.63) TRPM8EPHX1ALDH1A1CYP1A2NPC1
SCHEMBL2628647 0.83 TRPM8 (0.63) TRPM8EPHX1ALDH1A1CYP1A2NPC1
SCHEMBL2628766 0.81 TRPM8 (0.60) TRPM8EPHX1ALDH1A1KMT2A
SCHEMBL2628754 0.80 TRPM8 (0.59) TRPM8EPHX1ALDH1A1CYP1A2NPC1
SCHEMBL2628739 0.79 TRPM8 (0.67) TRPM8EPHX1ALDH1A1NPC1RAB9A
SCHEMBL14565718 0.79 TRPM8 (0.67) TRPM8EPHX1ALDH1A1NPC1RAB9A
SCHEMBL2628764 0.78 TRPM8 (0.65) TRPM8EPHX1TRPV1ALDH1A1KMT2A
SCHEMBL10073486 0.78 TRPM8 (0.75) TRPM8EPHX1TRPV1ALDH1A1NPC1
SCHEMBL2628672 0.78 TRPM8 (0.75) TRPM8EPHX1TRPV1ALDH1A1NPC1
SCHEMBL4817319 0.78 TRPM8 (0.75) TRPM8EPHX1TRPV1ALDH1A1NPC1

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 10/4885BAZ2B 3176/4885MAPK14 3269/4885
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 8/4885BAZ2B 3796/4885MAPK14 3362/4885

“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.