SCHEMBL86131

SCHEMBL86131

CC(C)n1ccnc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Bromide SCHEMBL10990647 0.97
Hydrochloric Acid SCHEMBL4251018 0.97
Fluoride SCHEMBL28816395 0.97
SCHEMBL29212735 0.91 CYP17A1 (0.44)
Bicarbonate SCHEMBL28505567 0.89 KDM4E (0.46)
Sulfuric Acid SCHEMBL28771647 0.87 CYP19A1 (0.40)
Formic Acid SCHEMBL28843279 0.87 CYP19A1 (0.40)
Sulfuric Acid SCHEMBL28771651 0.87 CYP19A1 (0.40)
Phosphoric Acid SCHEMBL28121884 0.87 FDPS (0.43)
SCHEMBL459642 0.83 CYP19A1 (0.48)

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

Appears in 2634 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120040779-A Azacyclo-carbene silver catalyst based on MOF framework and preparation method and application thereof 华南理工大学 2025-05-27 CN claimed
US-20250163049-A1 FUSED BICYCLIC HETEROCYCLYL COMPOUNDS AS USP1 INHIBITORS EXELIXIS INC (US) 2025-05-22 US claimed
CN-115945214-B Liquid phase catalytic solution for synthesizing vinyl chloride by hydrochlorination of acetylene, application, method and device for synthesizing vinyl chloride and application method 厦门中科易工化学科技有限公司 2025-05-02 CN claimed
CN-119774630-A Metal aluminum phosphate molecular sieve and synthesis method thereof 中国石油化工股份有限公司 2025-04-08 CN claimed
CN-119661811-A Latent accelerator based on anhydride-tertiary amine dynamic ion pair, preparation method and application thereof 江南大学 2025-03-21 CN claimed
CN-119565683-A Preparation method and application of copper-vanadium-tungsten oxygen cluster catalyst 聊城大学 2025-03-07 CN claimed
CN-119219021-A SCM-49 molecular sieve and preparation method thereof 中国石油化工股份有限公司 2024-12-31 CN claimed
CN-118879250-B Adhesive for aramid paper and PI film composite material and preparation method thereof 烟台泰和新材高分子新材料研究院有限公司 2024-12-27 CN claimed
CN-118085253-B Imidazolium polyester polyol, polyurethane synthesized by same and preparation method thereof 华东理工大学 2024-12-13 CN claimed
CN-118994611-A ZIF series photocatalyst and preparation method thereof 天津科技大学 2024-11-22 CN claimed
WO-2002012161-A1 PROCESS FOR THE CARBONYLATION OF OXIRANES DAVY PROCESS TECHNOLOGY LIMITED (GB) 2002-02-14 WO claimed
US-5270404-A Curable compositions of mesogen-containing advanced epoxy resins and curing agents therefor THE DOW CHEMICAL COMPANY (US) 1993-12-14 US claimed
EP-0349763-B1 Compositions for enhancing transdermal penetration BRISTOL MYERS SQUIBB CO (US) 1993-12-08 EP claimed
US-5266660-A Curable compositions containing mesogenic epoxy compounds and cured products thereof THE DOW CHEMICAL CO. (US) 1993-11-30 US claimed
EP-0349763-A1 Compositions for enhancing transdermal penetration Bristol-Myers Squibb Company (US) 1990-01-10 EP claimed
EP-0113917-B1 METHOD AND COMPOSITIONS FOR REMOVAL OF UNDESIRABLE ORGANIC MATTER AMERICAN CYANAMID COMPANY (US) 1987-04-01 EP claimed
EP-0117825-B1 THE USE OF BISPHENATE SALTS OF TERTIARY AMINES AS LATENT CURING OR ACCELERATING AGENTS FOR EPOXY-PHENOLIC SYSTEMS, METHOD FOR THEIR PREPARATION AND EPOXY-PHENOLIC SYSTEMS CONTAINING THEM MANUFACTURE DE PRODUITS CHIMIQUES PROTEX (FR) 1987-04-01 EP claimed
US-4499246-A A HALOBISPHENATE OF A TERTIARY AMINE; POT LIFE; RAPID HARDENING; COATINGS SOCIETE ANONYME DITE "MANUFACTURE DE PRODUITS CHIMIQUES PROTEX" (FR) 1985-02-12 US claimed
EP-0113917-A1 Method and compositions for removal of undesirable organic matter AMERICAN CYANAMID COMPANY (US) 1984-07-25 EP claimed
US-4404359-A OXIDATION OF SUBSTITUTED MONOHYDRIC PHENOLS, THEN POLYMERIZATION IN PRESENCE OF CATALYST COMPLEX CONSISTING OF COPPER SALT AND N-SUBSTITUTED IMIDAZOLE BASF AKTIENGESELLSCHAFT (DE) 1983-09-13 US claimed