SCHEMBL82917

SCHEMBL82917

Cc1ccc(C)c(C)n1

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
SCHEMBL29504006 1.00
SCHEMBL30035986 0.87 NOS3 (0.44)
SCHEMBL27495787 0.78 CCR1 (0.41)
SCHEMBL13825779 0.75 CCR1 (0.48)
SCHEMBL3071714 0.75 NOS3 (0.55)
SCHEMBL19217641 0.75 S100A4 (0.45)
SCHEMBL12849520 0.73
Ammonia Solution, Strong SCHEMBL29136365 0.71 NOS3 (0.44)
SCHEMBL14182364 0.71 NOS3 (0.44)
SCHEMBL9127151 0.71

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 1056 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624521-A Ionic covalent organic framework material, solid phase synthesis method and application thereof 耀科新材料(苏州)有限公司 2024-03-01 CN claimed
WO-2024037615-A1 IONIC COVALENT ORGANIC FRAMEWORK MATERIAL, SOLID-PHASE SYNTHESIS METHOD THEREOF, AND USE THEREOF 耀科新材料(天津)有限公司 2024-02-22 WO claimed
EP-4201973-A1 PREPOLYMER COMPRISING A POLYOXYMETHYLENE BLOCK AND METHOD FOR PRODUCING THE SAME Covestro Deutschland AG (DE) 2023-06-28 EP claimed
US-9796800-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2017-10-24 US claimed
EP-2814809-B1 NOVEL PROCESS FOR THE MANUFACTURE OF METHYL LIMONITRILE DSM IP ASSETS BV (NL) 2017-03-22 EP claimed
CN-104114534-B The method of manufacture methyl lemonile 帝斯曼知识产权资产管理有限公司 2017-03-08 CN claimed
US-9458096-B2 Process for the manufacture of methyl limonitrile DSM IP ASSETS B.V. (NL) 2016-10-04 US claimed
US-20160108153-A1 PROCESS FOR PRODUCING POLYDIENES BRIDGESTONE CORPORATION (JP) 2016-04-21 US claimed
CN-103154044-B Process for producing polydienes BRIDGESTONE CO.,LTD. (JP) 2016-02-17 CN claimed
US-9249244-B2 Process for producing polydienes BRIDGESTONE CORPORATION (JP) 2016-02-02 US claimed
WO-2000032602-A2 METHOD FOR THE DEMETHOXYCARBONYLATION OF PORPHYRINIC COMPOUNDS SUCH AS PHEOPHORBIDES MIRAVANT PHARMACEUTICALS, INC. (US) 2000-06-08 WO claimed
US-5973141-A Method for the demethoxycarbonylation of porphyrinic compounds such as pheophorbides MIRAVANT PHARMACEUTICALS, INC. (US) 1999-10-26 US claimed
EP-0325061-B1 Process for producing poly (para-phenylene-sulfide) TOSOH CORP (JP) 1995-12-06 EP claimed
US-4871848-A OIL, GAS WELLS CORROSION INHIBITORS THE DOW CHEMICAL COMPANY (US) 1989-10-03 US claimed
US-4740320-A REACTION OF NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPONENT, KETONE OR ALDEHYDE, AMINE OR POLYAMINE THE DOW CHEMICAL COMPANY (US) 1988-04-26 US claimed
EP-0220204-A1 THERMOSETTABLE POLYSTYRYLPYRIDINE PREPOLYMER TERMINATED WITH ETHYLENICALLY UNSATURATED GROUPS AND CURED PRODUCTS THEREFROM THE DOW CHEMICAL COMPANY (US) 1987-05-06 EP claimed
WO-1986006386-A1 THERMOSETTABLE POLYSTYRYLPYRIDINE PREPOLYMER TERMINATED WITH ETHYLENICALLY UNSATURATED GROUPS AND CURED PRODUCTS THEREFROM THE DOW CHEMICAL COMPANY (US) 1986-11-06 WO claimed
US-4578439-A Styryl pyridine cyanates, styryl pyrazine cyanates and polymers thereof THE DOW CHEMICAL COMPANY (US) 1986-03-25 US claimed
US-4575542-A Thermosettable polystyrylpyridine prepolymer terminated with ethylenically unsaturated groups and cured products therefrom THE DOW CHEMICAL COMPANY (US) 1986-03-11 US claimed
US-3966821-A OXIDATION CATALYSTS, CHROMIC OR CHROMOUS NAPHENATE, ALKYL-PYRIDINE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-06-29 US claimed