SCHEMBL2862097

SCHEMBL2862097

CCc1ccc(CC)c([O])c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.44
CYP2A6 P11509 2/20 0.43
CYP1A2 P05177 1/20 0.43
ALDH1A1 P00352 3/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
CA2 P00918 1/20 0.37
TP53 P04637 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HPGD P15428 2/20 0.35
BACE1 P56817 1/20 0.35
KIF11 P52732 1/20 0.35

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
SCHEMBL2863264 0.80 TRPA1 (0.44) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL444673 0.79 TRPA1 (0.48) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL4818051 0.78 TRPA1 (0.43) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL10415226 0.78 KAT8 (0.49) ALDH1A1LMNATP53KDM4ELPL
SCHEMBL14764213 0.76 TRPA1 (0.64) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL4279450 0.75 TRPA1 (0.44) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL394899 0.75 NOS3 (0.45) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
Ethylene SCHEMBL27875997 0.75 TRPA1 (0.44) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL5050079 0.75 TRPA1 (0.44) TRPA1CYP2A6CYP1A2ALDH1A1NPC1
SCHEMBL9487860 0.75 TRPA1 (0.44) TRPA1CYP2A6CYP1A2ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4365180-A1 RARE EARTH COMPLEX Tosoh Corporation (JP) 2024-05-08 EP disclosed
CN-117616032-A Rare earth complex 东曹株式会社 2024-02-27 CN disclosed
WO-2023190472-A1 CYCLOHEXYLENEDIAMINIUM SALT, USE THEREOF, AND MSE TYPE ZEOLITE OBTAINED USING SAME 公益財団法人相模中央化学研究所 2023-10-05 WO disclosed
WO-2023282236-A1 RARE EARTH COMPLEX 東ソー株式会社 2023-01-12 WO disclosed
US-20210340346-A1 METAL FILM-COATED MOLDED RESIN ARTICLES AND PRODUCTION METHOD THEREFOR MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2021-11-04 US disclosed
EP-3851553-A1 METAL-COATED MOLDED RESIN ARTICLES AND PRODUCTION METHOD THEREFOR Mitsubishi Engineering-Plastics Corporation (JP) 2021-07-21 EP disclosed
US-10988494-B2 Europium complex TOSOH CORPORATION (JP) 2021-04-27 US disclosed
CN-112654728-A Resin molded article with metal film and method for producing same 三菱工程塑料株式会社 2021-04-13 CN disclosed
US-20200354389-A1 EUROPIUM COMPLEX SAGAMI CHEMICAL RESEARCH INSTITUTE (JP) 2020-11-12 US disclosed
CN-111406059-A Europium complexes 东曹株式会社 2020-07-10 CN disclosed
WO-2020054705-A1 METAL-COATED MOLDED RESIN ARTICLES AND PRODUCTION METHOD THEREFOR 三菱エンジニアリングプラスチックス株式会社 2020-03-19 WO disclosed
US-20180057685-A1 FLAME-RETARDANT RESIN COMPOSITION ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-03-01 US disclosed
US-8653176-B2 Thermally conductive material and thermally conductive sheet molded from the thermally conductive material ASAHI KASEI E-MATERIALS CORPORATION (JP) 2014-02-18 US disclosed
US-8562873-B2 Flame retarder composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-10-22 US disclosed
US-7759418-B2 Flame retardant resin composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2010-07-20 US disclosed
US-20100012884-A1 THERMALLY CONDUCTIVE MATERIAL AND THERMALLY CONDUCTIVE SHEET MOLDED FROM THE THERMALLY CONDUCTIVE MATERIAL ASAHI KASEI KABUSHIKI KAISHA (JP) 2010-01-21 US disclosed
US-20080051495-A1 Flame Retardant Resin Composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2008-02-28 US disclosed
US-20070040154-A1 Flame retarder composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2007-02-22 US disclosed
US-7060744-B2 Phosphazene composition ASAHI KASEI CHEMICALS CORPORATION (JP) 2006-06-13 US disclosed
US-20040039134-A1 Phosphazene composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2004-02-26 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 (3 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-10988494-B2 Europium complex SSB, XPA, UACA TRPA1 3213/4885CYP2A6 1000/4885CYP1A2 1130/4885
US-20200354389-A1 EUROPIUM COMPLEX SSB, XPA, UACA TRPA1 3213/4885CYP2A6 1000/4885CYP1A2 1130/4885
US-20180057685-A1 FLAME-RETARDANT RESIN COMPOSITION PRPF4, RPL4, PSMB4 TRPA1 2865/4885CYP2A6 1529/4885CYP1A2 706/4885

“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.