SCHEMBL76728

SCHEMBL76728

Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1OC(c1c(C)cc(C(C)(C)C)cc1C(C)(C)C)C(CO)(CO)CO

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
RXRA P19793 7/20 0.31
PPARG P37231 6/20 0.31
RARG P13631 3/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30

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
SCHEMBL379576 0.90 RXRA (0.33) ALDH1A1RXRAPPARGRARGRARA
SCHEMBL28724572 0.89 SMN1; SMN2 (0.36) ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL10654607 0.88 ALDH1A1 (0.34) ALDH1A1RXRARXRBHTR1DHTR1B
SCHEMBL8644112 0.88
SCHEMBL1074119 0.86 RXRA (0.31) RXRAPPARGRARGRARARARB
SCHEMBL25435252 0.82
SCHEMBL9578946 0.82
SCHEMBL2186175 0.81 RXRA (0.33) ALDH1A1RXRAPPARGRARGRARA
SCHEMBL77036 0.81 SMN1; SMN2 (0.39) ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL28222090 0.80 RXRA (0.31) RXRAPPARG

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

Appears in 3516 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106905684-B Polyketone molding compounds having improved properties, molded articles made therefrom and method of making same EMS专利股份公司 2023-09-22 CN claimed
US-11760865-B2 Halogen-free sulphonic acid ester and/or sulphinic acid ester as flame retardant, flame retardant synergists and radical generators in plastics Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2023-09-19 US claimed
EP-3476876-B1 PROCESS FOR THE PREPARATION OF SILYLATED POLYURETHANE POLYMERS USING TITANIUM-CONTAINING AND ZIRCONIUM-CONTAINING CATALYSTS MOMENTIVE PERFORMANCE MAT INC (US) 2023-08-09 EP claimed
EP-3649190-B1 POLYETHYLENE COMPOSITION SABIC GLOBAL TECHNOLOGIES BV (NL) 2023-03-29 EP claimed
US-11591467-B2 Thermoplastic polymer composites and methods for preparing, collecting, and tempering 3D printable materials and articles from same G6 MATERIALS CORP. (US) 2023-02-28 US claimed
CN-110869429-B Polyethylene composition SABIC环球技术有限责任公司 2023-02-07 CN claimed
CN-110945066-B Halogen-free sulfonate and/or sulfinate esters as flame retardants, flame retardant synergists and free radical generators in plastics 弗劳恩霍弗应用研究促进协会 2022-10-14 CN claimed
US-20220282064-A1 STABILIZER COMPOSITION BASF SE (DE) 2022-09-08 US claimed
US-11365307-B2 Polyethylene composition SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2022-06-21 US claimed
EP-4004099-A1 STABILIZER COMPOSITION BASF SE (DE) 2022-06-01 EP claimed
US-20050165141-A1 Thermally stable cationic photocurable compositions CIBA SPECIALTY CHEMICALS CORP. 2005-07-28 US claimed
US-6872764-B2 Stabilized gamma irradiated polyolefins CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-03-29 US claimed
US-6816655-B2 EXCELLENT THERMAL OXIDATIVE STABILITY; GREASE-LIKE COMPOSITION OF (A)A SULFUR COMPOUND CONTAINING PRIMARY PHENOLIC ANTIOXIDANT; (B) MIXTURE OF ALKYL BUTYL/OCTYL DIPHENYLAMINE; AND (C) AN ORGANIC PHOSPHITE OR PHOSPHONITE CIBA SPECIALTY CHEMICALS CORPORATION 2004-11-09 US claimed
US-20040097619-A1 Flame retardant compositions CIBA SPECIALTY CHEMICALS CORP. 2004-05-20 US claimed
EP-1379584-A1 FLAME RETARDANT COMPOSITIONS Ciba Specialty Chemicals Holding Inc. (CH) 2004-01-14 EP claimed
US-6664317-B2 Stabilizer system to attenuate the deleterious effects of gamma irradiation consists of a hindered amine, a compound selected from hydroxylamine, nitrone, amine oxide, benzofuranone or mixture; free of phenol antioxidants CIBA SPECIALTY CHEMICALS CORPORATION 2003-12-16 US claimed
US-20030195282-A1 Stabilized gamma irradiated polyolefins KING ROSWELL E (US) 2003-10-16 US claimed
US-20030142932-A1 Copper and optical fiber cable with improved filling material CIBA SPECIALTY CHEMICALS CORP. 2003-07-31 US claimed
WO-2002074847-A1 FLAME RETARDANT COMPOSITIONS CIBA SPECIALITY CHEMICALS HOLDING INC. (CH) 2002-09-26 WO claimed
US-20020086924-A1 Stabilized gamma irradiated polyolefins CIBA SPECIALTY CHEMICALS CORP. 2002-07-04 US claimed