SCHEMBL11341

SCHEMBL11341

CC(C)c1ccccc1-c1cccc(C(C)C)c1C(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.44
GABRB2 P47870 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
LMNA P02545 2/20 0.44
FAAH O00519 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
GABRB1 P18505 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR2C P28335 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
HTR2B P41595 1/20 0.44
GABRA2 P47869 1/20 0.44

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
Hydrochloric Acid SCHEMBL15609199 0.96 GABRA1 (0.41) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL8761362 0.93 GABRA1 (0.50) GABRA1GABRB2CA1CA2GABRG2
Phosphoric Acid SCHEMBL3912751 0.89 PTPN5 (0.43) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL167078 0.85 GABRA1 (0.55) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL29414063 0.85 GABRA1 (0.55) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL8043769 0.84 ALDH1A1 (0.50) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL8142318 0.84 CA1 (0.41) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL29769741 0.84 CA1 (0.41) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL28762441 0.84 GABRA1 (0.57) GABRA1GABRB2CA1CA2GABRG2
SCHEMBL1841574 0.84 GABRA1 (0.57) GABRA1GABRB2CA1CA2GABRG2

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 1076 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359401-A1 PROCESS FOR PREPARING EGFR INHIBITORS Blueprint Medicines Corporation (US) 2024-05-01 EP claimed
CN-117384129-A Impurity compound, preparation method and application thereof 浙江九洲药业股份有限公司 2024-01-12 CN claimed
WO-2022271801-A1 PROCESS FOR PREPARING EGFR INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2022-12-29 WO claimed
CN-115052855-A Preparation method of amide compound, crystal form and salt thereof 昊运股份有限公司 2022-09-13 CN claimed
CN-114773263-A Preparation method of (R) -2,2, 4-trimethyl-1, 2,3, 4-tetrahydroquinoline 江苏百康德医药科技有限公司 2022-07-22 CN claimed
CN-114685251-A Direct cross-coupling reaction method of diaryl sulfoxide and aryl bromide 南京工业大学 2022-07-01 CN claimed
CN-109705012-B Preparation method of 2, 5-diaryl five-membered heterocyclic aromatic hydrocarbon 西北师范大学 2022-04-05 CN claimed
CN-110582495-B Fused pentacyclic imidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2022-04-01 CN claimed
CN-111534286-B Pulse blending production device and production method for high-temperature synthesis of organic heat carrier 山东北方淄特特种油股份有限公司 2021-10-01 CN claimed
CN-112094266-A Pyrrolopyridinone compound, preparation method, composition and application thereof 中国科学院上海药物研究所 2020-12-18 CN claimed
EP-3280599-A1 PRESSURE IMAGING AND INDICATING MATERIALS AND DEVICES Greener, Bryan (GB) 2018-02-14 EP claimed
US-5847040-A Lower alkyl biphenyls as plasticizers for polyurethane KOCH INDUSTRIES, INC. (US) 1998-12-08 US claimed
US-5696184-A EPOXY POLYMER CONTAINING DIISOPROPYLBIPHENYL AND/OR TRIISOPROPYLBIPHENYL; INCREASED FLEXIBILITY AND TOUGHNESS KOCH INDUSTRIES, INC. (US) 1997-12-09 US claimed
EP-0601690-B1 Solvent for use in carbonless paper, comprising diisopropylbiphenyl and triisopropylbiphenyl, and products utilising the same KOCH IND INC (US) 1997-04-23 EP claimed
US-5489646-A CAN USE HIGH LOAD LEVELS KOCH INDUSTRIES, INC. (US) 1996-02-06 US claimed
US-5458974-A Low odor carbonless paper solvent KOCH INDUSTRIES, INC. (US) 1995-10-17 US claimed
EP-0671124-A1 Solid biocidal concentrates ROHM AND HAAS COMPANY (US) 1995-09-13 EP claimed
US-5430046-A Containing a melting point depressant which is miscible; repeatedly meltable, solidifiable ROHM AND HAAS COMPANY (US) 1995-07-04 US claimed
EP-0601690-A1 Solvent for use in carbonless paper, comprising diisopropylbiphenyl and triisopropylbiphenyl, and products utilising the same KOCH INDUSTRIES, INC. (US) 1994-06-15 EP claimed
US-5318940-A Writing or printing recording sheet with coating having microcapsules containing chromogen and odorless solvent KOCH INDUSTRIES, INC. (US) 1994-06-07 US claimed