SCHEMBL57414

SCHEMBL57414

CC(C)(N)C#N

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
Hydrochloric Acid SCHEMBL696386 0.96
SCHEMBL11734562 0.96
Acetone SCHEMBL11322589 0.83 LMNA (0.38)
SCHEMBL3203300 0.82
SCHEMBL7326551 0.80 ALDH1A1 (0.30)
SCHEMBL28309172 0.78
SCHEMBL11352073 0.75
SCHEMBL11303032 0.75
SCHEMBL13587695 0.75
Tert-Butylamine SCHEMBL28255169 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121574414-A Double-network hydrogel coating with high transparency, antibacterial property and toughness, and preparation method and application thereof 山东大学 2026-02-27 CN claimed
CN-119455863-A Cyantraniliprole method for synthesizing amide 浙江中山化工集团股份有限公司 2025-02-18 CN claimed
US-20230033510-A1 Compounds and Methods for Treatment of Visceral Pain ARENA PHARMACEUTICALS, INC. 2023-02-02 US claimed
CN-109563085-B Piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2022-08-09 CN claimed
EP-3490986-B1 PIPERIDINE CXCR7 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-11-24 EP claimed
CN-109627225-B Continuous production method of multi-kettle series triazine herbicide 山东师范大学 2021-04-02 CN claimed
US-20210060040-A1 CANNABINOID RECEPTOR MODULATORS ARENA PHARMACEUTICALS, INC. 2021-03-04 US claimed
CN-108329236-B Preparation method of enzalutamide intermediate 盐城师范学院 2020-12-29 CN claimed
EP-2804607-B1 SYNTHESIS OF RALTEGRAVIR EMCURE PHARMACEUTICALS LTD (IN) 2020-09-16 EP claimed
US-10752620-B2 Piperdine CXCR7 receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2020-08-25 US claimed
EP-0241735-A2 Acyloxythiophene carbon amide BAYER AG (DE) 1987-10-21 EP claimed
US-RE31136-E Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1983-02-01 US claimed
EP-0001813-B1 IMIDAZOLIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, INTERMEDIATES FOR USE IN THIS PROCESS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THE USE OF THE ACTIVE COMPOUNDS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-11-04 EP claimed
US-4252717-A Preparation of 2,2'-azobis(2-methylpropionitrile) SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-02-24 US claimed
EP-0001813-A1 Imidazolidine derivatives, process for their preparation, intermediates for use in this process, pharmaceutical compositions containing them and the use of the active compounds F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-05-16 EP claimed
US-4092150-A Herbicidal 5-pyrimidinecarbonitriles FMC CORPORATION (US) 1978-05-30 US claimed
US-4058662-A Process for the substitution of chlorine atoms of cyanuric chloride DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1977-11-15 US claimed
US-4054739-A Process for the substitution of chlorine atoms of cyanuric chloride DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1977-10-18 US claimed
US-4051124-A Process for producing an azonitrile with improved color from an aminonitrile in an aqueous system comprising mixed surface active compounds E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-27 US claimed
US-4028345-A Process for the preparation of azodinitriles from aminonitriles in the presence of a surfactant E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-06-07 US claimed