SCHEMBL7450427

SCHEMBL7450427

CCC(=O)c1ccc(C)c(C)c1C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.47
POLB P06746 1/20 0.40
MAPT P10636 3/20 0.38
KDM4E B2RXH2 1/20 0.38
UBE2N P61088 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HMGCR P04035 1/20 0.36
KMT2A Q03164 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 2/20 0.35
ACHE P22303 1/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 2/20 0.34
CA9 Q16790 1/20 0.33

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
SCHEMBL9720621 0.83 HSP90AB1 (0.48) HSP90AB1POLBMAPTKDM4EUBE2N
SCHEMBL507731 0.83 TSHR (0.46) POLBHSD17B10ALDH1A1KMT2AL3MBTL1
SCHEMBL28866488 0.82 HSP90AB1 (0.43) HSP90AB1POLBMAPTKDM4EUBE2N
SCHEMBL28836187 0.82 POLB (0.43) HSP90AB1POLBMAPTKDM4EUBE2N
SCHEMBL11574084 0.82 HSP90AB1 (0.43) HSP90AB1POLBMAPTKDM4EUBE2N
SCHEMBL581465 0.81 ESR1 (0.46) HSP90AB1KDM4EHSD17B10ALDH1A1KMT2A
SCHEMBL30578286 0.81 ESR1 (0.46) HSP90AB1KDM4EHSD17B10ALDH1A1KMT2A
SCHEMBL9720563 0.79 HSP90AB1 (0.44) HSP90AB1POLBKDM4EALDH1A1HMGCR
SCHEMBL17420773 0.79 HSP90AB1 (0.44) HSP90AB1POLBMAPTKDM4EUBE2N
SCHEMBL9720637 0.79 HSP90AB1 (0.44) HSP90AB1POLBMAPTHSD17B10ALDH1A1

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
CN-122037655-A Water-based ink for cigarette case packaging and preparation method thereof 英科卡乐油墨(湖北)有限公司 2026-05-15 CN disclosed
CN-118834343-A Molecular woven polymer aerogel material and preparation method thereof 上海交通大学 2024-10-25 CN disclosed
CN-104254534-B Modulators of HEC1 activity and methods thereof 泰纬生命科技股份有限公司 2017-07-14 CN disclosed
CN-105358516-A Method of acylating an aromatic compound DSM IP ASSETS BV 2016-02-24 CN disclosed
CN-104254534-A Modulators of HEC1 activity and methods thereof TAIVEX THERAPEUTICS CORP 2014-12-31 CN disclosed
CN-103958487-A Benzoic acid derivatives as eif4e inhibitors HOFFMANN LA ROCHE 2014-07-30 CN disclosed
EP-0980369-A1 SULFONAMIDES FOR TREATMENT OF ENDOTHELIN-MEDIATED DISORDERS TEXAS BIOTECHNOLOGY CORPORATION (US) 2000-02-23 EP disclosed
CN-1219953-A Fabric softening compound/composition PROCTER & GAMBLE (US) 1999-06-16 CN disclosed
WO-1998049162-A1 SULFONAMIDES FOR TREATMENT OF ENDOTHELIN-MEDIATED DISORDERS TEXAS BIOTECHNOLOGY CORPORATION (US) 1998-11-05 WO disclosed
US-5103022-A Reacting dl-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino -1-propanone with l-acetylphenylglycine to form corresponding diastereomeric salt, deposition, isolation of l-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino-1-propanone NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1992-04-07 US disclosed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP disclosed
US-5057535-A Muscle relaxants NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-10-15 US disclosed
US-4677193-A GONADOTROPIN-RELEASING FACTOR ANALOGS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1987-06-30 US disclosed
EP-0200942-A2 New derivatives of an aminoketone NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1986-11-12 EP disclosed
EP-0192492-A2 Peptides containing an aliphatic-aromatic ketone side chain THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1986-08-27 EP disclosed