SCHEMBL316288

SCHEMBL316288

Cc1cc(C)cc(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
POLB P06746 2/20 0.50
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TYR P14679 2/20 0.43
CA2 P00918 1/20 0.43
HTR1D P28221 3/20 0.42
HSPA5 P11021 1/20 0.39
HTR1B P28222 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2C9 P11712 1/20 0.38
HIF1A Q16665 1/20 0.38
TACR1 P25103 1/20 0.37
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1655430 0.93 GABRA1 (0.55) TSHRPOLBGABRA1GABRB2RXRA
Formaldehyde SCHEMBL27921022 0.91 RXRB (0.46) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL9290257 0.87 ALDH1A1 (0.60) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL28522118 0.85 RXRB (0.60) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL14840527 0.84 RXRB (0.42) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL28784149 0.84 RXRA (0.42) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL27346286 0.83 GABRA1 (0.52) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL27312394 0.83 GABRA1 (0.46) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL28946872 0.83 GABRA1 (0.52) TSHRPOLBGABRA1GABRB2RXRA
SCHEMBL21385251 0.83 POLB (0.38) TSHRPOLBGABRA1GABRB2RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025125484-A1 AN ALCOHOL CONVERSION PROCESS BASF SE (DE) 2025-06-19 WO claimed
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US claimed
WO-2025040772-A1 A PROCESS FOR PREPARING AT LEAST ONE HYDROCARBON FROM AT LEAST ONE ALCOHOL BASF SE (DE) 2025-02-27 WO claimed
CN-119118842-A Method for safely producing musk ketone 太仓又绿日化材料有限公司 2024-12-13 CN claimed
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117897439-A Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117362294-A Polyquinoline acridine diketone macrocyclic derivative and preparation method and application thereof 广东工业大学 2024-01-09 CN claimed
CN-116239436-A Method for synthesizing 5-tertiary butyl meta-xylene by adopting tubular reactor 山东兴文工业技术研究院有限公司 2023-06-09 CN claimed
CN-116217401-A Safe and continuous production method for preparing xylene musk 山东兴文工业技术研究院有限公司 2023-06-06 CN claimed
WO-2023033605-A1 METHOD FOR SCREENING SOLVENT FOR EXTRACTING POLYVINYL CHLORIDE, METHOD FOR RECYCLING WASTE, RECYCLED POLYVINYL CHLORIDE, AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO claimed
US-6503662-B1 Tert-butylbenzene derivative prevents oxidation and decomposition of solvent at the time of charging which causes decreased battery characteristics UBE INDUSTRIES, LTD. (JP) 2003-01-07 US claimed
US-6355826-B1 HALOMETHYLATION AN AROMATIC ALDEHYDE COMPOUND AND SALT FORMATION THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-12 US claimed
EP-0903338-A2 Synthesis of stable nitrile oxide compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1999-03-24 EP claimed
CN-1099279-A Artificial musk serial anti-inflammatory and anticancer compound Chinese patent medicine and making process thereof BEIFANG MEDICINE DEVEL INST ZU (CN) 1995-03-01 CN claimed
CN-1088574-A 2, the synthetic method of the 6-dimethyl-4-tertiary butyl-3-nitro-phenethyl cyanogen CHINESE ACAD INST CHEMISTRY (CN) 1994-06-29 CN claimed
US-5162376-A ALKYLBENZENES FOR COMBATING NEMATODES BASF AKTIENGESELLSCHAFT (DE) 1992-11-10 US claimed
EP-0459288-A1 Alkylbenzenes for the control of nematodes BASF Aktiengesellschaft (DE) 1991-12-04 EP claimed
US-4827026-A COBALT, BROMINE, MANGANESE CATALYST AMOCO CORPORATION (US) 1989-05-02 US claimed
US-4340758-A Nitration process for the preparation of 2,6-dialkylaniline CHEVRON RESEARCH COMPANY (US) 1982-07-20 US claimed
US-4340757-A CUPROUS HALIDE CATALYZED AMINATION CHEVRON RESEARCH COMPANY (US) 1982-07-20 US claimed