SCHEMBL181204

SCHEMBL181204

CC(C)c1ccccc1OOC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 3/20 0.40
LMNA P02545 3/20 0.40
GABRA1 P14867 2/20 0.40
GABRB2 P47870 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
TSHR P16473 2/20 0.40
SLC6A2 P23975 2/20 0.40
FAAH O00519 1/20 0.40
HPGD P15428 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
PTGS1 P23219 1/20 0.40
HTR2C P28335 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
HTR2B P41595 1/20 0.40
GABRA2 P47869 1/20 0.40

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
SCHEMBL29350441 1.00 CYP1A2 (0.40) CYP1A2CYP3A4LMNAGABRA1GABRB2
Benzene SCHEMBL28562494 0.98 GABRA1 (0.39) CYP1A2CYP3A4LMNAGABRA1GABRB2
Hydrogen Peroxide SCHEMBL29231462 0.96 TSHR (0.42) CYP1A2CYP3A4LMNAGABRA1GABRB2
Isopropyl Alcohol SCHEMBL20457518 0.94 LMNA (0.41) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL8527815 0.88 KMT2A (0.35) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL978796 0.85 GABRA1 (0.42) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL809484 0.83 GABRA1 (0.41) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL30471557 0.83 AR (0.37) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL30471505 0.83 KMT2A (0.38) CYP1A2CYP3A4LMNAGABRA1GABRB2
SCHEMBL9130041 0.83 GABRA1 (0.48) CYP1A2CYP3A4LMNAGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118852515-A Solvent type acrylic resin and preparation method and application thereof 盛虹(上海)新材料科技有限公司 2024-10-29 CN claimed
CN-115403889-B Modified polylactic acid and preparation thereof and application of modified polylactic acid to blowing of high-toughness fully-degradable polylactic acid film 四川大学 2024-09-13 CN claimed
CN-118459923-A Modified PLA/PBAT blend and preparation method thereof 四川大学 2024-08-09 CN claimed
CN-118373934-A Method for preparing acrylic ester powder resin by precipitation polymerization method and application 盛虹(上海)新材料科技有限公司 2024-07-23 CN claimed
WO-2024138515-A1 BENZOCYCLOBUTENE RESIN, RESIN COMPOSITION CONTAINING SAME, AND USE THEREOF 广东生益科技股份有限公司 2024-07-04 WO claimed
WO-2024130761-A1 BENZOCYCLOBUTENE RESIN, RESIN COMPOSITION, AND USE THEREOF 广东生益科技股份有限公司 2024-06-27 WO claimed
CN-117625104-A Epoxy resin adhesive composition 西安道生化工科技有限公司 2024-03-01 CN claimed
CN-115003413-B Process for preparing double metal cyanide catalysts 科思创德国股份有限公司 2024-02-27 CN claimed
CN-115260945-B Polypropylene adhesive resin and preparation method and application thereof 赣州能之光新材料有限公司 2024-02-20 CN claimed
CN-117413000-A Polyurethane product and method for producing a polyurethane product 陶氏环球技术有限责任公司 2024-01-16 CN claimed
CN-101245125-A High-current ethylene-vinyl acetate copolymer inarch maleic anhydride product, preparation method and application thereof GUANGZHOU HECHENG CHEMICAL CO (CN) 2008-08-20 CN claimed
CN-101121799-A Low-luster polypropylene blending modified material and preparation method thereof GUANGZHOU BOSI PLASTIC PIGMENT (CN) 2008-02-13 CN claimed
US-5658510-A TREATING FIBERS WITH ADDITIVE FOR BETTER COMPATIBILITY WITH POLYOLEFIN RESINS ENICHEM S.P.A. (IT) 1997-08-19 US claimed
EP-0275925-B1 Rubbery copolymers of ethylene, propylene and a nonconjugated polyene and their use SUMITOMO CHEMICAL CO (JP) 1995-04-05 EP claimed
US-5179156-A Ethylene, propylene, ethylidene norbornene or dicyclopenta-diene with specific ingredients ratios; auto parts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-01-12 US claimed
EP-0275925-A2 Rubbery copolymers of ethylene, propylene and a nonconjugated polyene and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-07-27 EP claimed
US-4626488-A Polymeric binder for toner having specific weight distribution CANON KABUSHIKI KAISHA (JP) 1986-12-02 US claimed
EP-0071662-B1 METHOD FOR MANUFACTURING LOW DENSITY RUBBER FOAMED BODY Toyo Rubber Chemical Industrial Corporation (JP) 1986-11-12 EP claimed
US-4596684-A Kneading mixture of rubber and foaming agent, adding crosslinking agent, forming sheet, molding TOYO RUBBER CHEMICAL INDUSTRIAL CORPORATION (JP) 1986-06-24 US claimed
EP-0071662-A1 Method for manufacturing low density rubber foamed body Toyo Rubber Chemical Industrial Corporation (JP) 1983-02-16 EP claimed