Sugi Predict

Sugi Predict / Compounds / SCHEMBL4637145

SCHEMBL4637145

SCHEMBL4637145

CC(=O)C(=O)OC1CC(C)CCC1C(C)C

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHX1 P07099 3/20 0.57
▸ ALDH1A1 P00352 9/20 0.52
▸ HPGD P15428 2/20 0.52
▸ CYP19A1 P11511 2/20 0.51
▸ TRPA1 O75762 2/20 0.46
▸ TRPM8 Q7Z2W7 2/20 0.46
▸ TSHR P16473 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPK1 P28482 1/20 0.43

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
SCHEMBL13430523 1.00 EPHX1 (0.57) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL6387314 0.91 EPHX1 (0.61) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL16194851 0.91 EPHX1 (0.61) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL1335321 0.88 EPHX1 (0.52) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL14559200 0.87 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL1320016 0.87 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL19900165 0.87 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL7927510 0.87 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL5354058 0.87 EPHX1 (0.55) EPHX1ALDH1A1HPGDCYP19A1TRPA1
SCHEMBL15305973 0.87 EPHX1 (0.57) EPHX1ALDH1A1HPGDCYP19A1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108503548-B Pyruvic acid menthyl ester cooling agent and preparation method thereof 长沙鑫本助剂有限公司 2021-04-06 — — CN claimed
CN-109576099-A For the coolant agent component in beer and its it is made into method 昆山亚香香料股份有限公司 2019-04-05 — — CN claimed
CN-108503548-A A kind of pyruvic acid menthyl ester coolant agent and preparation method thereof 长沙鑫本助剂有限公司 2018-09-07 — — CN claimed
CN-108503548-B Pyruvic acid menthyl ester cooling agent and preparation method thereof 长沙鑫本助剂有限公司 2021-04-06 — — CN disclosed
CN-108503548-B Pyruvic acid menthyl ester cooling agent and preparation method thereof 长沙鑫本助剂有限公司 2021-04-06 — — CN disclosed
CN-108503548-B Pyruvic acid menthyl ester cooling agent and preparation method thereof 长沙鑫本助剂有限公司 2021-04-06 — — CN disclosed
CN-108503548-A A kind of pyruvic acid menthyl ester coolant agent and preparation method thereof 长沙鑫本助剂有限公司 2018-09-07 — — CN disclosed
CN-108503548-A A kind of pyruvic acid menthyl ester coolant agent and preparation method thereof 长沙鑫本助剂有限公司 2018-09-07 — — CN disclosed
CN-108503548-A A kind of pyruvic acid menthyl ester coolant agent and preparation method thereof 长沙鑫本助剂有限公司 2018-09-07 — — CN disclosed
CN-101287699-B Menthyl lactate process MILLENIUM SPECIALTY CHEMICALS 2012-01-11 — — CN disclosed
CN-101287699-A Menthyl lactate process MILLENIUM SPECIALTY CHEMICALS (US) 2008-10-15 — — CN disclosed
EP-1934164-A1 MENTHYL LACTATE PROCESS Millennium Specialty Chemicals, Inc. (US) 2008-06-25 — — EP disclosed
WO-2007044146-A1 MENTHYL LACTATE PROCESS MILLENNIUM SPECIALTY CHEMICALS, INC. (US) 2007-04-19 — — WO disclosed
US-7173146-B1 Menthyl lactate process MILLENNIUM SPECIALTY CHEMICALS, INC. (US) 2007-02-06 — — US disclosed
EP-0098012-B1 PROCESS FOR PREPARING (O-HYDROXYARYL)-METHANOLS BLASCHIM S.p.A. (IT) 1986-09-17 — — EP disclosed
EP-0098012-A2 Process for preparing (o-hydroxyaryl)-methanols BLASCHIM S.p.A. (IT) 1984-01-11 — — EP disclosed