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 — —
SCHEMBL145276 0.80 ALDH1A1 (0.34) —
SCHEMBL29483754 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
Send feedback