SCHEMBL2641075

SCHEMBL2641075

CC(CO)c1ccc(C(C)CO)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.52
TRPA1 O75762 4/20 0.50
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
TAAR1 Q96RJ0 2/20 0.40
ACHE P22303 1/20 0.40
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
TSHR P16473 1/20 0.39
MIF P14174 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
CYP2C9 P11712 1/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL10396706 0.92 ABCB11 (0.47) ABCB11TRPA1ESR1ESR2CYP2C9
SCHEMBL6933308 0.92 ABCB11 (0.47) ABCB11TRPA1ESR1ESR2TAAR1
SCHEMBL10396707 0.92 ABCB11 (0.47) ABCB11TRPA1ESR1ESR2CYP2C9
SCHEMBL9694221 0.92 ABCB11 (0.47) ABCB11TRPA1ESR1ESR2FFAR1
SCHEMBL548248 0.89 ESR1 (0.61) ABCB11TRPA1ESR1ESR2TAAR1
SCHEMBL12195408 0.89 ACHE (0.53) ABCB11TRPA1ESR1ESR2ACHE
SCHEMBL12195409 0.89 ESR1 (0.61) ABCB11TRPA1ESR1ESR2TAAR1
SCHEMBL20811781 0.89 ACHE (0.53) ABCB11TRPA1ESR1ESR2ACHE
SCHEMBL8076390 0.89 ABCB11 (0.46) ABCB11TRPA1ESR1ESR2TAAR1
SCHEMBL4492702 0.89 ACHE (0.53) ABCB11TRPA1ESR1ESR2ACHE

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240052091-A1 POLYURETHANE COMPOSITIONS HAVING IMPROVED FORCE RETENTION AND MOISTURE RESISTANCE BAY MATERIALS, LLC. 2024-02-15 US claimed
WO-2023176765-A1 HYDROXY RESIN, STYRENE RESIN, METHOD FOR PRODUCING HYDROXY RESIN, METHOD FOR PRODUCING STYRENE RESIN, AND APPLICATIONS THEREOF 三菱瓦斯化学株式会社 2023-09-21 WO claimed
EP-0009602-A1 Process for preparing indanyl polymers BAYER AG (DE) 1980-04-16 EP claimed
EP-4711398-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2026-03-18 EP disclosed
WO-2024237153-A1 BIS[1-METHYL-1-(4-HYDROXYALKOXY-3-ALKYLPHENYL) ETHYL ]BENZENE COMPOUND AND METHOD FOR PRODUCING SAME, AND CRYSTAL AND METHOD FOR PRODUCING SAME 本州化学工業株式会社 2024-11-21 WO disclosed
WO-2024237154-A1 THERMOPLASTIC RESIN AND OPTICAL LENS INCLUDING SAME 三菱瓦斯化学株式会社 2024-11-21 WO disclosed
US-20240052091-A1 POLYURETHANE COMPOSITIONS HAVING IMPROVED FORCE RETENTION AND MOISTURE RESISTANCE BAY MATERIALS, LLC. 2024-02-15 US disclosed
WO-2023232613-A1 PROCESS FOR MANUFACTURING OF HIGHER FUNCTIONAL POLYISOBUTENES BASF SE (DE) 2023-12-07 WO disclosed
WO-2023176763-A1 RESIN COMPOSITION, CURED PRODUCT, PREPREG, METAL-FOIL-CLAD LAMINATE, RESIN COMPOSITE SHEET, PRINTED CIRCUIT BOARD, AND SEMICONDUCTOR DEVICE 三菱瓦斯化学株式会社 2023-09-21 WO disclosed
WO-2023176766-A1 RESIN, RESIN COMPOSITION, CURED PRODUCT, PREPREG, METAL FOIL-CLAD LAMINATE, RESIN COMPOSITE SHEET, PRINTED WIRING BOARD, AND SEMICONDUCTOR DEVICE 三菱瓦斯化学株式会社 2023-09-21 WO disclosed
WO-2023176764-A1 RESIN COMPOSITION, CURED PRODUCT, PREPREG, METAL FOIL-CLAD LAMINATE, RESIN COMPOSITE SHEET, PRINTED WIRING BOARD, AND SEMICONDUCTOR DEVICE 三菱瓦斯化学株式会社 2023-09-21 WO disclosed
JP-2005314270-A METHOD FOR PRODUCING DIISOPROPENYLBENZENE SUMITOMO CHEMICAL CO LTD 2005-11-10 JP disclosed
EP-0901043-B1 Radiation-sensitive resin composition JSR CORP (JP) 2004-10-27 EP disclosed
JP-2004231586-A METHOD FOR PRODUCING CHLORINATED AROMATIC COMPOUND KANEGAFUCHI CHEM IND CO LTD 2004-08-19 JP disclosed
US-5624965-A Arylenedialkylidene polymers for high performance ion exchange membranes THE GRAVER COMPANY (US) 1997-04-29 US disclosed
EP-0374999-B1 Use of oligomers of alkenyl groups-substituted aromatics as co-agents AKZO NOBEL NV (NL) 1995-01-18 EP disclosed
US-5091479-A Crosslinking synthetic rubbers with a dimer, trimer of an oligomer of a di(alkenyl(3-6))-substituted aromatic compound AKZO NV (NL) 1992-02-25 US disclosed
US-5010161-A Of poly (phenylenebisalkylene) poly (phenylamine) with aldehyde, regenerated under hydrolysis, for use in moisture curable polyurethanes MITSUI TOATSU CHEMICALS, INC. (JP) 1991-04-23 US disclosed
EP-0374999-A2 Use of oligomers of alkenyl groups-substituted aromatics as co-agents Akzo Nobel N.V. (NL) 1990-06-27 EP disclosed
EP-0009602-A1 Process for preparing indanyl polymers BAYER AG (DE) 1980-04-16 EP disclosed