SCHEMBL938679

SCHEMBL938679

CC(C)(C)c1cc(CO)c(O)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
MAPK1 P28482 3/20 0.49
NPSR1 Q6W5P4 2/20 0.49
GAA P10253 2/20 0.49
HTT P42858 2/20 0.49
XBP1 P17861 1/20 0.49
CYP2C19 P33261 7/20 0.48
HSPA5 P11021 2/20 0.48
CYP2C9 P11712 6/20 0.47
HIF1A Q16665 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CYP1A2 P05177 5/20 0.45
TSHR P16473 3/20 0.45
CYP3A4 P08684 2/20 0.45
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45
KLF10 Q13118 1/20 0.44
HSP90AA1 P07900 1/20 0.44
POLB P06746 1/20 0.43
TYR P14679 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
SCHEMBL29577789 1.00 ALDH1A1 (0.49) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL9447261 0.90 CYP2C19 (0.47) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL196675 0.87 CYP2C19 (0.61) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL466567 0.86 CYP2C19 (0.50) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL39554 0.86 HSPA5 (0.66) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL30903568 0.86 HSPA5 (0.66) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL29500375 0.86 HSPA5 (0.66) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL3685892 0.84 HSPA5 (0.63) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL2786708 0.84 CYP2C19 (0.67) ALDH1A1MAPK1NPSR1GAAHTT
SCHEMBL8028498 0.84 HSPA5 (0.55) ALDH1A1MAPK1NPSR1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030109643-A1 COMPOSITIONS HAVING ETHYLENIC BACKBONE AND BENZYLIC, ALLYLIC, OR ETHER-CONTAINING SIDE-CHAINS, OXYGEN SCAVENGING COMPOSITIONS CONTAINING SAME, AND PROCESS FOR MAKING THESE COMPOSITIONS BY ESTERIFICATION OR TRANSESTERIFICATION OF A POLYMER MELT CRYOVAC, INC. 2003-06-12 US claimed
US-5229243-A Addition polymer core, polyurethane or polythiourethane shell KAO CORPORATION (JP) 1993-07-20 US claimed
US-20250163296-A1 POLYESTERAMIDE COMPOSITIONS FOR METAL PACKAGING COATINGS EASTMAN CHEMICAL COMPANY (US) 2025-05-22 US disclosed
EP-4473031-A1 POLYESTERAMIDE COMPOSITIONS FOR METAL PACKAGING COATINGS Eastman Chemical Company (US) 2024-12-11 EP disclosed
CN-118019780-A Polyimide, polyimide precursor, composition, and method for producing polyimide 富士胶片株式会社 2024-05-10 CN disclosed
CN-116693578-A Iron-based complex and preparation method thereof, and method for preparing polycarbonate and catalyzing polymerization of epoxy cyclohexane and phthalic anhydride by catalysis 中国石油大学(北京) 2023-09-05 CN disclosed
WO-2023147326-A1 POLYESTERAMIDE COMPOSITIONS FOR METAL PACKAGING COATINGS EASTMAN CHEMICAL COMPANY (US) 2023-08-03 WO disclosed
WO-2023054221-A1 POLYIMIDE, POLYIMIDE PRECURSOR, COMPOSITION, AND PRODUCTION METHOD FOR POLYIMIDE 富士フイルム株式会社 2023-04-06 WO disclosed
WO-2023054222-A1 COMPOSITION, CURED PRODUCT, METHOD FOR PRODUCING CURED PRODUCT, STRUCTURE, AND DEVICE 富士フイルム株式会社 2023-04-06 WO disclosed
CN-114369122-B Iron-based complex, preparation method thereof and method for preparing polyepoxy cyclohexane by catalysis of iron-based complex 中国石油大学(北京) 2023-03-28 CN disclosed
US-11440986-B2 Solid electrolyte composition, binder for all-solid-state secondary batteries, and electrode sheet for batteries and all-solid-state secondary battery each using said solid electrolyte FUJIFILM CORPORATION (JP) 2022-09-13 US disclosed
EP-0106169-B1 SUBSTITUTED 2-(2,6-DI-T-BUTYL-4-ALKYLPHENOXY) 4H-1,3,2-BENZODIOXAPHOSPHORINS AND COMPOSITIONS THEREOF The B.F. GOODRICH Company (US) 1988-01-07 EP disclosed
US-4529533-A Substituted 2-(2,6-di-t-butly-4-alkylphenoxy) 4H-1,3,2-benzodioxaphosphorins and compositions thereof THE B. F. GOODRICH COMPANY (US) 1985-07-16 US disclosed
EP-0106169-A1 Substituted 2-(2,6-di-t-butyl-4-alkylphenoxy) 4H-1,3,2-benzodioxaphosphorins and compositions thereof The B.F. GOODRICH Company (US) 1984-04-25 EP disclosed
EP-0104643-A2 5-Membered cyclic phosphonates and compositions thereof The B.F. GOODRICH Company (US) 1984-04-04 EP disclosed
US-4439564-A 5-Membered cyclic phosphonates and compositions thereof THE B. F. GOODRICH CO. (US) 1984-03-27 US disclosed
US-4067933-A OXIDATION RESISTANCE THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-01-10 US disclosed
US-4035435-A FORMALDEHYDE, RESORCINOL COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN, RAISON SOCIALE MICHELIN & CIE (FR) 1977-07-12 US disclosed
US-4025454-A PHENOLIC RESIN BLEND COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN, RAISON SOCIALE MICHELIN & CIE (FR) 1977-05-24 US disclosed
US-3959221-A OXIDATIVE DEGRADATION THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-05-25 US disclosed