SCHEMBL2628622

SCHEMBL2628622

Cc1ccccc1CCNC(=O)[C@@H]1C[C@H](C)CC[C@H]1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.48
EPHX1 P07099 1/20 0.43
RXFP1 Q9HBX9 1/20 0.41
TP53 P04637 2/20 0.40
MAPT P10636 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
THRB P10828 1/20 0.39
P2RX4 Q99571 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39

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
SCHEMBL24540387 1.00 TRPM8 (0.48) TRPM8EPHX1RXFP1TP53MAPT
SCHEMBL24540369 0.89 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL24540793 0.89 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL24540494 0.89 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL29112383 0.89 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL15131615 0.88 TRPM8 (0.47) TRPM8EPHX1RXFP1TAAR1
SCHEMBL2628625 0.88 TRPM8 (0.49) TRPM8EPHX1MAPTTAAR1
SCHEMBL10192725 0.88 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL24540253 0.88 TRPM8 (0.47) TRPM8EPHX1P2RX4SIGMAR1TAAR1
SCHEMBL2628691 0.88 TRPM8 (0.47) TRPM8EPHX1RXFP1TAAR1

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 8 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-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
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 2902/4885RXFP1 404/4885
US-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 8/4885EPHX1 2270/4885RXFP1 301/4885

“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.