SCHEMBL160135

SCHEMBL160135

COc1cc[c]c(C)c1

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
SCHEMBL28465430 0.92 ALDH1A1 (0.39)
SCHEMBL7479452 0.85 ACHE (0.41)
SCHEMBL5778859 0.79 CYP1A1 (0.55)
SCHEMBL7839219 0.78 CYP1A1 (0.55)
SCHEMBL15066961 0.78 ALDH1A1 (0.41)
SCHEMBL11099027 0.77 ABL1 (0.52)
SCHEMBL28824959 0.77 ABL1 (0.52)
SCHEMBL20240552 0.77 HTT (0.55)
SCHEMBL15905122 0.76 MTNR1A (0.48)
SCHEMBL77754 0.76 CA1 (0.39)

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 1627 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11987588-B2 Modulators of the beta-3 adrenergic receptor useful for the treatment or prevention of heart failure and disorders related thereto ARENA PHARMACEUTICALS, INC. (US) 2024-05-21 US claimed
US-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2023-11-16 US claimed
US-20230339904-A1 ISOINDOLINONES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2023-10-26 US claimed
CN-116669725-A Novel aminopyridine and use thereof in the treatment of cancer 奥克兰联合服务有限公司 2023-08-29 CN claimed
EP-4217357-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER Auckland Uniservices Limited (NZ) 2023-08-02 EP claimed
EP-3720858-B1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF HEART FAILURE AND DISORDERS RELATED THERETO ARENA PHARM INC (US) 2023-06-07 EP claimed
US-20230052586-A1 DISUBSTITUTED ALKYNE DERIVATIVES MERCK PATENT GMBH (DE) 2023-02-16 US claimed
CN-114044742-B Chiral primary amine malonamide compound and preparation method and application thereof 河北工业大学 2023-02-10 CN claimed
EP-3898588-B1 DISUBSTITUTED ALKYNE DERIVATIVES MERCK PATENT GMBH (DE) 2023-01-11 EP claimed
US-20220396579-A1 MODULATORS OF THE BETA-3 ADRENERGIC RECEPTOR USEFUL FOR THE TREATMENT OR PREVENTION OF HEART FAILURE AND DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. 2022-12-15 US claimed
US-4906250-A Process for the preparation of water-insoluble azo dyes on the fiber: impregnating with coupling component and treating with diazonium salt of 4-chloro-2,5-dialkoxy aniline HOECHST AKTIENGESELLSCHAFT, A CORP. OF THE FEDERAL REPUBLIC OF GERMANY (DE) 1990-03-06 US claimed
EP-0312003-A2 Process of manufacturing water insolubles azodyes on the fibre HOECHST AKTIENGESELLSCHAFT (DE) 1989-04-19 EP claimed
US-4769493-A Process for producing tetrafluorophthalic acid SDS BIOTECH K.K. (JP) 1988-09-06 US claimed
EP-0259663-A1 Process for producing tetrafluorophihalic acid SDS Biotech K.K. (JP) 1988-03-16 EP claimed
US-4696675-A Process for preparing water-insoluble blue azo dyes on the fiber: hydroxynaphthoic amide and diazotized di-alkoxy-benzidine HOECHST AKTIENGESELLSCHAFT (DE) 1987-09-29 US claimed
EP-0199973-A2 Process for the production on the fibre of water insoluble azo dyes HOECHST AKTIENGESELLSCHAFT (DE) 1986-11-05 EP claimed
US-4440845-A CHARGE TRANSFER COMPOUND RICOH CO., LTD. (JP) 1984-04-03 US claimed
US-4356193-A Animal feed and process THE UPJOHN COMPANY (US) 1982-10-26 US claimed
US-4058516-A DISAZO DYES SANDOZ LTD. (CH) 1977-11-15 US claimed
US-3950538-A Anti-inflammatory methods utilizing certain thioureas THE DOW CHEMICAL COMPANY (US) 1976-04-13 US claimed