SCHEMBL21459

SCHEMBL21459

CC(C)c1cc[c]cc1

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
SCHEMBL27717161 0.97 TYR (0.39)
SCHEMBL27374847 0.97 TYR (0.39)
SCHEMBL28232445 0.97 TYR (0.39)
SCHEMBL27871094 0.94 TYR (0.37)
SCHEMBL27575184 0.94 TYR (0.37)
SCHEMBL11046872 0.89 TYR (0.39)
SCHEMBL27258896 0.89 TYR (0.34)
Magnesium Chloride Anhydrous SCHEMBL28293588 0.89 TYR (0.34)
SCHEMBL28365283 0.89 TYR (0.34)
SCHEMBL533910 0.84 NISCH (0.42)

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 24268 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239776-A1 AZASPIROCYCLES AS MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-07-18 US claimed
CN-118344291-A Method for preparing imide by rearrangement of isoamide and application thereof 中国石油化工股份有限公司 2024-07-16 CN claimed
CN-118344292-A Acenaphthene derivative and preparation method thereof, acenaphthene derivative material and preparation method and application thereof 中国石油化工股份有限公司 2024-07-16 CN claimed
CN-118344293-A Acenaphthene dimer derivative, and preparation method and application thereof 中国石油化工股份有限公司 2024-07-16 CN claimed
CN-118344695-A Hydroxyl-enriched cycloolefin copolymer long afterglow material and application thereof 重庆理工大学 2024-07-16 CN claimed
CN-118324823-A Heterofluorene rare earth compound, preparation method thereof and application thereof in olefin polymerization 中国科学院长春应用化学研究所 2024-07-12 CN claimed
EP-3143063-B1 PREPARATIONS HAVING THERMOPLASTIC POLYURETHANE AND A LOW BASE NUMBER BASF SE (DE) 2024-07-10 EP claimed
CN-118307593-A Tri-dentate phosphinopyrrolimine ligand, preparation method thereof, ethylene oligomerization catalyst and application thereof 万华化学集团股份有限公司 2024-07-09 CN claimed
CN-118317992-A Dual UV blocker comprising a shelf-life stable photoactive bulk polymerized polycycloolefin composition as an optical material 普罗米鲁斯有限责任公司 2024-07-09 CN claimed
US-20240217913-A2 PREPARATION OF SUBSTITUTED ACRYLATE COMPOUND HUA MEDICINE (SHANGHAI) LTD. (CN) 2024-07-04 US claimed
US-4118561-A ANTIBACTERIAL, SYNERGISTIC, ANTI-CANCER ACTIVITY, ANTI-FOLIC ACID ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 1978-10-03 US claimed
US-4086246-A REACTION OF PHOSGENE WITH A PHENOL AND PRIMARY AMINE CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA (HU) 1978-04-25 US claimed
US-4070400-A MICROBIOCIDES, ALGICIDES MERCK & CO., INC. (US) 1978-01-24 US claimed
US-3981716-A CORN, WEEDS STAUFFER CHEMICAL COMPANY (US) 1976-09-21 US claimed
US-3965220-A AMINE CATALYST MONSANTO COMPANY (US) 1976-06-22 US claimed
US-3960862-A PHARMACOLOGICAL USE BASF AKTIENGESELLSCHAFT (DT) 1976-06-01 US claimed
US-3956307-A FUNGICIDES SCHERING AKTIENGESELLSCHAFT (DT) 1976-05-11 US claimed
US-3945891-A Distillation process for purification of triaryl phosphate esters FMC CORPORATION (US) 1976-03-23 US claimed
US-3936410-A Triaryl phosphate ester plasticizers for polyvinyl chloride compositions FMC CORPORATION (US) 1976-02-03 US claimed
US-3932630-A Triazolyl phosphorus esters as pesticides CIBA-GEIGY CORPORATION (US) 1976-01-13 US claimed