SCHEMBL730083

SCHEMBL730083

CCCCCC1CCC(=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.52
TLR4 O00206 1/20 0.41
PKM P14618 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
DRD2 P14416 1/20 0.39
CHRM3 P20309 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
CCR2 P41597 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
EPHX1 P07099 1/20 0.38
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
TP53 P04637 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
SCHEMBL11036095 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL9139886 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL8640867 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL2853523 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL11082717 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL7737007 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL6736225 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL9356259 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL16730084 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4
SCHEMBL7737003 0.98 CYP1A2 (0.50) CYP1A2TLR4PKMCHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250075147-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NEW FLAVOR AND FRAGRANCE INGREDIENTS OSMO LABS, PBC 2025-03-06 US claimed
CN-119409615-A 2- (Indol-3-yl) phenol compound and synthesis method thereof 湘潭大学 2025-02-11 CN claimed
US-20240400784-A1 Method for Screening Solvent for Extracting Polyvinyl Chloride, Method for Recycling Waste, Recycled Polyvinyl Chloride, and Composition LG CHEM, LTD. (KR) 2024-12-05 US claimed
US-20240392094-A1 Method for Screening Solvent for Polyvinyl Chloride Extraction, Recycling Method for Waste Material, and Recycled Polyvinyl Chloride and Composition LG CHEM, LTD. (KR) 2024-11-28 US 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-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-117126178-A Bisphenol thiazide compound and synthesis method thereof 湘潭大学 2023-11-28 CN claimed
WO-2023033601-A1 METHOD FOR SCREENING SOLVENT FOR POLYVINYL CHLORIDE EXTRACTION, RECYCLING METHOD FOR WASTE MATERIAL, AND RECYCLED POLYVINYL CHLORIDE AND COMPOSITION 주식회사 엘지화학 2023-03-09 WO 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
CN-109438318-B Synthesis method of 3-aryl indole and derivatives thereof 湖南医药学院 2022-05-03 CN claimed
CN-104177298-B Bis- substitution -4,5- dihydros -1H of 4,4--imidazoles -5- ketone, derivative and its synthetic method 湘潭大学 2018-10-02 CN claimed
CN-107619386-A A kind of aromatic ring simultaneously [c] carbazole analog derivative and its synthetic method 湘潭大学 2018-01-23 CN claimed
CN-107417705-A Imidazo [2,1 b] benzothiazole compound and its synthetic method 湘潭大学 2017-12-01 CN claimed
CN-106916089-A A kind of preparation method of the cis 4 n-pentyl cyclohexylmercaptan of selectivity synthesis 大连九信精细化工有限公司 2017-07-04 CN claimed
US-9290691-B2 Organic el material-containing solution, method for forming organic el thin film, organic el device comprising organic el thin film, and method for manufacturing organic el display panel IDEMITSU KOSAN CO., LTD. (JP) 2016-03-22 US claimed
EP-2020225-B1 Fragrance composition KAO CORP (JP) 2014-10-08 EP claimed
EP-2020225-A2 Fragrance composition Kao Corporation (JP) 2009-02-04 EP claimed
US-20050245407-A1 Fragrance composition KAO CORPORATION (JP) 2005-11-03 US claimed
EP-1552814-A1 FRAGRANCE COMPOSITION Kao Corporation (JP) 2005-07-13 EP claimed
US-5618982-A SIMPLE INDUSTRIAL PROCESS OF CATALYZING IN PRESENCE OF METALLIC PHOSPHATES RHONE-POULENC CHIMIE (FR) 1997-04-08 US claimed