SCHEMBL2628746

SCHEMBL2628746

CCN1CCN(c2ccc(NC(=O)[C@@H]3C[C@H](C)CCC3C(C)C)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.60
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
ATM Q13315 1/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.42
NR4A1 P22736 1/20 0.41
ESR2 Q92731 1/20 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
SCHEMBL663622 0.86 TRPM8 (0.64) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10073861 0.86 TRPM8 (0.64) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2628763 0.80 TRPM8 (0.70) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2628674 0.79 TRPM8 (0.60) TRPM8KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL15131613 0.79 TRPM8 (0.62) TRPM8KMT2AMAPTALDH1A1LMNA
SCHEMBL2628681 0.79 TRPM8 (0.62) TRPM8KMT2AMAPTALDH1A1LMNA
SCHEMBL10073486 0.78 TRPM8 (0.75) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL2628672 0.78 TRPM8 (0.75) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4817319 0.78 TRPM8 (0.75) TRPM8MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4820732 0.78 TRPM8 (0.75) TRPM8MEN1KMT2ASMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20120094977-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION TRPC4, TRPC3, TRPC1 TRPM8 8/4885MEN1 2516/4885KMT2A 4664/4885

“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.