SCHEMBL663340

SCHEMBL663340

COc1ccc(NC(=O)C2CC(C)CCC2C(C)C)cc1Cl

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.69
ALDH1A1 P00352 3/20 0.53
HPGD P15428 2/20 0.53
MALT1 Q9UDY8 7/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.45

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
SCHEMBL2628679 1.00 TRPM8 (0.69) TRPM8ALDH1A1HPGDMALT1SMN1; SMN2
SCHEMBL6334721 0.90 TRPM8 (0.73) TRPM8ALDH1A1SMN1; SMN2NPSR1L3MBTL1
SCHEMBL19189293 0.88 TRPM8 (0.70) TRPM8ALDH1A1HPGDMALT1SMN1; SMN2
SCHEMBL371165 0.88 TRPM8 (0.70) TRPM8ALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL2628764 0.88 TRPM8 (0.65) TRPM8ALDH1A1
SCHEMBL10072945 0.87 TRPM8 (0.69) TRPM8MAPT
SCHEMBL2628755 0.85 TRPM8 (0.63) TRPM8ALDH1A1MALT1SMN1; SMN2L3MBTL1
SCHEMBL12835229 0.85 ALDH1A1 (0.56) TRPM8ALDH1A1HPGDMALT1SMN1; SMN2
SCHEMBL15131638 0.85 TRPM8 (0.63) TRPM8ALDH1A1MALT1SMN1; SMN2L3MBTL1
SCHEMBL4883161 0.84 TRPM8 (0.67) TRPM8ALDH1A1HPGDSMN1; SMN2LMNA

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 28/4885ALDH1A1 3429/4885HPGD 1122/4885
US-20120045448-A1 TRP-P8 ACTIVE COMPOUNDS AND THERAPEUTIC TREATMENT METHODS TSG101, TP53, BAX TRPM8 28/4885ALDH1A1 3429/4885HPGD 1122/4885

“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.