SCHEMBL8427632

SCHEMBL8427632

CC(C)C(C)(C)OC(=O)C=CC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.54
GABRP O00591 2/20 0.41
GABRD O14764 2/20 0.41
GABRA1 P14867 2/20 0.41
GABRB1 P18505 2/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRA5 P31644 2/20 0.41
GABRA3 P34903 2/20 0.41
GABRA2 P47869 2/20 0.41
GABRB2 P47870 2/20 0.41
GABRA4 P48169 2/20 0.41
GABRE P78334 2/20 0.41
GABRA6 Q16445 2/20 0.41
GABRG1 Q8N1C3 2/20 0.41
GABRG3 Q99928 2/20 0.41
GABRQ Q9UN88 2/20 0.41
TSHR P16473 3/20 0.39
TP53 P04637 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39

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
SCHEMBL11746565 1.00 HCAR2 (0.54) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11747544 1.00 HCAR2 (0.54) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11746578 0.91 HCAR2 (0.39) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11747549 0.91 HCAR2 (0.39) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL4583811 0.91 HCAR2 (0.39) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11747208 0.86 HCAR2 (0.48) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11747191 0.86 HCAR2 (0.48) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL11748618 0.86 HCAR2 (0.48) HCAR2GABRPGABRDGABRA1GABRB1
Hydrochloric Acid SCHEMBL27348490 0.84 HCAR2 (0.47) HCAR2GABRPGABRDGABRA1GABRB1
SCHEMBL8101892 0.84 HCAR2 (0.47) HCAR2GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105085805-B Polystyrene dipropyl butenedioate as well as preparation method and application thereof 中国石油天然气股份有限公司 2017-09-01 CN claimed
CN-105085805-A Polystyrene dipropyl butenedioate as well as preparation method and application thereof PETROCHINA CO LTD 2015-11-25 CN claimed
EP-2598470-B1 FORMULATIONS SYNGENTA LTD (GB) 2021-01-20 EP disclosed
CN-109721529-A A kind of simple and convenient process for preparing of 2,5- dichloropyridine 新发药业有限公司 2019-05-07 CN disclosed
CN-105829368-B Method for applying dispersion adhesives 瓦克化学股份公司 2018-07-06 CN disclosed
CN-105793379-B For applying the method for dispersion adhesive 瓦克化学股份公司 2018-06-15 CN disclosed
CN-107404927-A Multiple supplement compositions 麦莱琉卡有限公司 2017-11-28 CN disclosed
CN-105085805-B Polystyrene dipropyl butenedioate as well as preparation method and application thereof 中国石油天然气股份有限公司 2017-09-01 CN disclosed
CN-104364278-B Vinyl acetate copolymers for hydraulically setting construction material masses 瓦克化学股份公司 2017-04-12 CN disclosed
US-9458085-B2 Formulations SYNGENTA LIMITED (GB) 2016-10-04 US disclosed
CN-105829368-A Method For Applying Dispersion Adhesives 瓦克化学股份公司 2016-08-03 CN disclosed
CN-1326429-A Utilisation of protective colloid-stabilised aromatic vinyl-1,3-diene-copolymers in adhesive formulations used in the building industry WACKER CHEMIE GMBH (DE) 2001-12-12 CN disclosed
CN-1312739-A Method for treating solid, especially alluminmium surfaces HENKEL CORP (US) 2001-09-12 CN disclosed
CN-1307547-A Vinyl aromatic-1,3-diene copolymers stabilised with protection colloids and used for modifying materials containing plaster or calcium carbonate WACKER CHEMIE GMBH (DE) 2001-08-08 CN disclosed
US-5925711-A AQUEOUS TWO-COMPONENT COATING COMPOSITION COMPRISING AS BINDER POLYAMINE PRODUCT OF MICHAEL CONDENSATION BETWEEN UNSATURATED OLIGOESTER AND (CYCLO)ALIPHATIC DIAMINE, WATER DISPERSIBLE POLYISOCYANATE BAYER AKTIENGESELLSCHAFT (DE) 1999-07-20 US disclosed
US-5521250-A ADDITION POLYMERS CONTAINING EPOXIDE AND ANHYDRIDE GROUPS, DICARBOXYLIC ACIDS AND THEIR ANHYDRIDES AS HARDENERS AND OPTIONAL URETIDIONE CROSSLINKERS; AUTOMOBILE CLEAR COATS;NONYELLOWING, SOLVENT AND CHEMICAL RESISTANT BAYER AKTIENGESELLSCHAFT (DE) 1996-05-28 US disclosed
US-5510444-A FLEXIBLE, DISCOLORATION INHIBITION BAYER AKTIENGESELLSCHAFT (DE) 1996-04-23 US disclosed
CN-1014235-B Process for production of dialkyl maleate DAVY MCKEE LTD (GB) 1991-10-09 CN disclosed
CN-87105385-A Technological process 1988-04-27 CN disclosed
US-4048130-A COPOLYMERIZATION, UNSATURATED ACIDS LONZA LTD. (CH) 1977-09-13 US disclosed