SCHEMBL534241

SCHEMBL534241

CCOC(=O)CC1CCCCC1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.55
KMT2A Q03164 3/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
GAA P10253 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 1/20 0.40
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA4 P22748 3/20 0.39
CA6 P23280 2/20 0.39
LMNA P02545 1/20 0.39
PTGS1 P23219 2/20 0.38
PTGS2 P35354 2/20 0.38
OPRK1 P41145 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.37

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
SCHEMBL11241585 1.00 CYP2D6 (0.55) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL11082604 0.98 CYP2D6 (0.54) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL10412651 0.98 CYP2D6 (0.54) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL1254599 0.95 CYP2D6 (0.49) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL28358461 0.86 CYP2D6 (0.42) CYP2D6KMT2ANPC1RAB9AGAA
Toluene SCHEMBL28301657 0.84 NPC1 (0.48) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL6036885 0.84 NPC1 (0.56) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL4058485 0.83 CA1 (0.44) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL19777580 0.83 CYP2D6 (0.42) CYP2D6KMT2ANPC1RAB9AGAA
SCHEMBL6024211 0.82 CYP2D6 (0.43) CYP2D6KMT2ARAB9AGAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
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-2025132542-A1 MACROCYCLIC OREXIN AGONISTS IDORSIA PHARMACEUTICALS LTD (CH) 2025-06-26 WO disclosed
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 disclosed
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 disclosed
CN-118043471-A Process for the production of (1 r,4 r) -4-substituted cyclohexane-1-amines 吉瑞工厂 2024-05-14 CN disclosed
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 disclosed
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 disclosed
CN-114845996-B Benzene ring-containing compound and application thereof 武汉朗来科技发展有限公司 2023-09-12 CN disclosed
EP-0338989-A1 Heterotetracyclic lactam derivatives, process for their preparation, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1989-10-25 EP disclosed
EP-0312539-A1 NEW ORGANIC COMPOUNDS HAVING OPIOID PROPERTIES THE VICTORIA UNIVERSITY OF MANCHESTER (GB) 1989-04-26 EP disclosed
WO-1988000193-A1 NEW ORGANIC COMPOUNDS HAVING OPIOID PROPERTIES THE VICTORIA UNIVERSITY OF MANCHESTER (GB) 1988-01-14 WO disclosed
US-4370323-A 2-Cyanoaziridinyl-(1)-2-substituted-aziridinyl-(1)-methanes BOEHRINGER MANNHEIM GMBH (DE) 1983-01-25 US disclosed
US-4356024-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1982-10-26 US disclosed
US-4128560-A Tricyclic alkylamine derivatives AYERST MCKENNA & HARRISON LTD. (CA) 1978-12-05 US disclosed
US-4033751-A 2-(Substituted-phenyl)-hexahydro- and tetrahydro-3-(2H)-cinnolinones as herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-07-05 US disclosed