SCHEMBL2586905

SCHEMBL2586905

COC(OC)C(=O)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
CES1 P23141 2/20 0.52
CES2 O00748 1/20 0.52
AKR1B1 P15121 1/20 0.52
PAM P19021 2/20 0.50
ALDH1A1 P00352 4/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CNR2 P34972 1/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
RAB9A P51151 2/20 0.45
MAPT P10636 1/20 0.45
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44

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
SCHEMBL22263585 0.85 ALOX5 (0.62) ALDH1A1LMNAHDAC6SMN1; SMN2RAB9A
SCHEMBL934793 0.84 TSHR (0.50) TSHRCES1CES2AKR1B1PAM
SCHEMBL9194640 0.82 HPGD (0.47) ALDH1A1L3MBTL1CNR2LMNAMEN1
SCHEMBL22263589 0.82 CA2 (0.52) ALDH1A1LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL6616395 0.79 TSHR (0.44) TSHRCES1CES2AKR1B1PAM
SCHEMBL331007 0.78 TSHR (0.57) TSHRCES1CES2AKR1B1ALDH1A1
SCHEMBL27810294 0.78 PAM (0.53) TSHRCES1CES2AKR1B1PAM
SCHEMBL7667014 0.77 ALDH1A1 (0.54) ALDH1A1MAPK1L3MBTL1LMNAKMT2A
SCHEMBL4725179 0.77 TSHR (0.55) TSHRCES1CES2AKR1B1ALDH1A1
SCHEMBL107178 0.77 TSHR (0.55) TSHRCES1CES2AKR1B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012076709-A1 MAGNETIC ACOUSTIC RESONATOR SENSOR CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-06-14 WO claimed
JP-9100259-A None JP disclosed
CN-105380668-B Method for continuously monitoring blood glucose change by using magnetoacoustic resonance 中科康磁医疗科技(苏州)有限公司 2020-10-16 CN disclosed
US-8394312-B1 Method for forming polymerized microfluidic devices SANDIA CORPORATION (US) 2013-03-12 US disclosed
CN-102796096-A Hexahydro dibenzo [a,g] quinolizidine compound and preparation method, medicinal composition and application thereof SHANGHAI INST MATERIA MEDICA 2012-11-28 CN disclosed
WO-2012076709-A1 MAGNETIC ACOUSTIC RESONATOR SENSOR CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-06-14 WO disclosed
US-8047829-B1 Method for forming polymerized microfluidic devices SANDIA CORPORATION (US) 2011-11-01 US disclosed
US-7654268-B2 Artificial nail form CARPENTER JUNE 2010-02-02 US disclosed
EP-1487770-B1 FORMATION OF NEOLIGNAN BY DDQ MEDIATED DIMERISATION OF DIHYDROASARONE COUNCIL SCIENT IND RES (IN) 2007-12-12 EP disclosed
US-20070277840-A1 Artificial nail form CARPENTER JUNE 2007-12-06 US disclosed
JP-H09100259-A PRODUCTION OF OPTICALLY ACTIVE SECONDARY AMINE SUMIKA FINE CHEM KK 1997-04-15 JP disclosed
EP-0750532-A1 CLEANING PROCESS Kao Corporation (JP) 1997-01-02 EP disclosed
WO-1995025606-A1 CLEANING PROCESS KAO CORPORATION (JP) 1995-09-28 WO disclosed
EP-0198743-B1 PROCESS FOR THE ELECTROSYNTHESIS OF KETONES SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1989-05-31 EP disclosed
EP-0247526-A2 Process for 3,4-dimethoxyphenyl-acetone preparation LARK S.p.A. (IT) 1987-12-02 EP disclosed
EP-0219367-A1 Organic electrolysis cell with a consumable electrode SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1987-04-22 EP disclosed
EP-0101223-B1 PROCESS FOR PRODUCING PHENYLACETONES UBE INDUSTRIES, LTD. (JP) 1987-04-01 EP disclosed
US-4629541-A ELECTROCHEMICAL REDUCTION OF ORGANICS HALIDES IN THE PRESENCE OF ACID ANHYDRIDES SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1986-12-16 US disclosed
EP-0198743-A1 Process for the electrosynthesis of ketones SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1986-10-22 EP disclosed
US-3987200-A INOTROPIC AGENTS, 3,4-DIHYDROXY-PHENYL-ALKYL PHENETHYLAMINE ELI LILLY AND COMPANY (US) 1976-10-19 US disclosed