SCHEMBL663149

SCHEMBL663149

CC1CCC(C(C)C)C(C(=O)Nc2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.70
TRPV1 Q8NER1 6/20 0.59
EPHX1 P07099 2/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
EPHX2 P34913 1/20 0.43
RAB9A P51151 1/20 0.41
GAA P10253 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
SCHEMBL10073873 1.00 TRPM8 (0.70) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL2628676 0.89 TRPM8 (0.69) TRPM8TRPV1EPHX1MEN1KMT2A
SCHEMBL4817319 0.86 TRPM8 (0.75) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL10073486 0.86 TRPM8 (0.75) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL2628672 0.86 TRPM8 (0.75) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL4820732 0.86 TRPM8 (0.75) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL10073506 0.85 TRPM8 (0.73) TRPM8TRPV1EPHX1MEN1ALDH1A1
SCHEMBL2628747 0.85 TRPM8 (0.73) TRPM8TRPV1EPHX1MEN1HTT
SCHEMBL2628777 0.85 TRPM8 (0.73) TRPM8TRPV1EPHX1MEN1KMT2A
SCHEMBL2628758 0.85 TRPM8 (0.73) TRPM8TRPV1EPHX1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120045448-A1 TRP-P8 ACTIVE COMPOUNDS AND THERAPEUTIC TREATMENT METHODS GENENTECH, INC. (US) 2012-02-23 US claimed
US-7893072-B2 Cool-genic compounds as anticarcinogenic agents promoting apoptosis and inhibit angiogenesis; antiproliferative agents GENENTECH, INC. (US) 2011-02-22 US claimed
US-20120045448-A1 TRP-P8 ACTIVE COMPOUNDS AND THERAPEUTIC TREATMENT METHODS GENENTECH, INC. (US) 2012-02-23 US disclosed
US-7893072-B2 Cool-genic compounds as anticarcinogenic agents promoting apoptosis and inhibit angiogenesis; antiproliferative agents GENENTECH, INC. (US) 2011-02-22 US disclosed
US-20050090514-A1 Trp-p8 active compounds and therapeutic treatment methods GENENTECH, INC. 2005-04-28 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-20050090514-A1 Trp-p8 active compounds and therapeutic treatment methods TSG101, TP53, BAX TRPM8 28/4885TRPV1 14/4885EPHX1 1033/4885
US-20120045448-A1 TRP-P8 ACTIVE COMPOUNDS AND THERAPEUTIC TREATMENT METHODS TSG101, TP53, BAX TRPM8 28/4885TRPV1 14/4885EPHX1 1033/4885

“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.