SCHEMBL21117

SCHEMBL21117

C=C(C)c1ccccc1C(C)(C)N=C=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL5597108 0.89 CYP3A4 (0.34)
SCHEMBL2459722 0.86
SCHEMBL29483754 0.80 ALDH1A1 (0.34)
SCHEMBL145276 0.80 ALDH1A1 (0.34)
SCHEMBL4077895 0.79
Hexamethylbenzene SCHEMBL28232121 0.74 CYP3A4 (0.38)
SCHEMBL713859 0.74 ALDH1A1 (0.48) MEN1NPC1HTTKMT2A
SCHEMBL6831708 0.73 GABRA1 (0.35)
SCHEMBL7519912 0.72 ALDH1A1 (0.37) MEN1NPC1KMT2A
SCHEMBL9051530 0.72 CYP3A4 (0.48) MEN1NPC1KMT2A

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 1092 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250320340-A1 PROCESSES FOR PRODUCING FILLED POLYOL COMPOSITIONS COVESTRO LLC (US) 2025-10-16 US claimed
CN-117402429-B Processing method of high-toughness MPP power tube 杭州金泰塑业有限公司 2024-07-19 CN claimed
CN-114085331-B Mussel bionic modified acrylic hybrid alkyd resin and preparation method thereof 长兴化学工业(中国)有限公司 2024-05-28 CN claimed
CN-117402429-A Processing method of high-toughness MPP power tube 杭州金泰塑业有限公司 2024-01-16 CN claimed
CN-114656602-B Prepolymer for polymer polyol and preparation method thereof 万华化学集团股份有限公司 2023-12-19 CN claimed
CN-117004301-A Solvent-borne coating composition suitable for forming a coating on three-piece food or beverage cans 广东华润涂料有限公司 2023-11-07 CN claimed
CN-112996830-B Ethylenically unsaturated macromers prepared from residues in isocyanate preparation and related preformed stabilizers 科思创有限公司 2023-04-11 CN claimed
US-20220315691-A1 POLYMER POLYOL COMPOSITIONS AND THEIR USE IN THE PRODUCTION OF FLEXIBLE POLYURETHANE FOAMS COVESTRO LLC 2022-10-06 US claimed
EP-4041787-A1 PREFORMED STABILIZERS WITH IMPROVED STABILITY Covestro LLC (US) 2022-08-17 EP claimed
US-11414544-B2 Ethylenically unsaturated macromers produced from a residue of isocyanate manufacturing, related preformed stabilizers, polymer polyols, foam-forming compositions and foams COVESTRO LLC (US) 2022-08-16 US claimed
EP-0345748-A2 Hard transparent resins and process for the production thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-12-13 EP claimed
EP-0336129-A2 Room temperature curing, alternating isopropenyldimethylbenzylisocyanate copolymers having high isocyanate fuctionality CYTEC TECHNOLOGY CORP. (US) 1989-10-11 EP claimed
US-4797449-A Resin compositions TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-01-10 US claimed
EP-0281910-A2 Resin compositions Takeda Chemical Industries, Ltd. (JP) 1988-09-14 EP claimed
EP-0127802-B1 META- AND PARA-ISOPROPENYL-ALPHA,ALPHA-DIMETHYLBENZYLAMINE AMERICAN CYANAMID COMPANY (US) 1988-04-20 EP claimed
EP-0164491-A1 Process for the preparation of tertiary aralkyl urethanes and process for the preparation of isocyanates derived therefrom AMERICAN CYANAMID COMPANY (US) 1985-12-18 EP claimed
EP-0130322-A2 Emulsion copolymerisation of meta- or para-isopropenyl-alpha,alpha-dimethylbenzylisocyanate AMERICAN CYANAMID COMPANY (US) 1985-01-09 EP claimed
EP-0127802-A2 Meta- and para-isopropenyl-alpha,alpha-dimethylbenzylamine AMERICAN CYANAMID COMPANY (US) 1984-12-12 EP claimed
US-4439616-A THERMAL CRACKING, ACID CATALYST AMERICAN CYANAMID COMPANY (US) 1984-03-27 US claimed
EP-0101832-A1 Tertiary aralkyl urethanes and isocyanates derived therefrom AMERICAN CYANAMID COMPANY (US) 1984-03-07 EP claimed