SCHEMBL5517192

SCHEMBL5517192

CC(C)CCCCOC(=O)C1CCC(C)CC1C(=O)OCCCCC(C)C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.39
EPHX1 P07099 1/20 0.38
ESR1 P03372 1/20 0.33
CAPN9 O14815 1/20 0.33
RARB P10826 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
PPARG P37231 1/20 0.31

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
SCHEMBL5515283 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL5524075 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL5523430 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL5518236 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL4776911 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL5531507 0.98 TRPM8 (0.38) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL27557370 0.93 TRPM8 (0.35) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL27557369 0.91 TRPM8 (0.36) TRPM8EPHX1ESR1CAPN9RARB
SCHEMBL1297739 0.87 CAPN9 (0.40) ESR1CAPN9RARBCHRM2CHRM4
SCHEMBL782037 0.85 TP53 (0.42) EPHX1RARBCHRM2CHRM4CHRM5

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-7282601-B2 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-10-16 US disclosed
EP-1838701-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2007-10-03 EP disclosed
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed
WO-2006078753-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2006-07-27 WO disclosed
US-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL, CO., LTD. (JP) 2005-02-17 US disclosed
EP-1227078-A1 DICARBOXYLIC DIESTER, PROCESS FOR PRODUCING THE SAME, AND REFRIGERATING MACHINE LUBRICATING OIL COMPRISING THE ESTER NEW JAPAN CHEMICAL CO.,LTD. (JP) 2002-07-31 EP 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-20050038283-A1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester SCO2, PDHX, DECR2 TRPM8 2218/4885EPHX1 279/4885ESR1 479/4885

“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.