Oxirane

Oxirane

SCHEMBL4884714

C1CO1.Oc1ccc(Cc2ccc(O)cc2)cc1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.74
ESR2 Q92731 2/20 0.74
KEAP1 Q14145 1/20 0.46
ABAT P80404 1/20 0.46
CA2 P00918 3/20 0.44
GSK3B P49841 1/20 0.43
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
PTPN1 P18031 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
IDO1 P14902 2/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
SLC6A2 P23975 1/20 0.42
CYP2C19 P33261 1/20 0.42
HTR3A P46098 1/20 0.42
BACE1 P56817 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL36454 0.86 ESR1 (1.00) ESR1ESR2KEAP1ABATCA2
SCHEMBL2969737 0.86 ESR1 (1.00) ESR1ESR2KEAP1ABATCA2
Hydroquinone SCHEMBL2867425 0.83 ALOX15 (0.61) ESR1ESR2CA2ALDH1A1KDM4E
SCHEMBL5790255 0.80 PRKDC (0.54) ESR1ESR2GSK3BALDH1A1KDM4E
SCHEMBL10434816 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2
SCHEMBL1121382 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2
SCHEMBL833872 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2
Phloroglucinol SCHEMBL686858 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2
SCHEMBL22451383 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2
Formaldehyde SCHEMBL6014338 0.78 ESR1 (0.82) ESR1ESR2KEAP1ABATCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080220191-A1 Thermal Transfer Receiving Sheet OJI PAPER CO., LTD. (JP) 2008-09-11 US disclosed
EP-1870249-A1 THERMAL TRANSFER RECEIVING SHEET OJI PAPER COMPANY LIMITED (JP) 2007-12-26 EP disclosed
EP-1302471-B1 SULFUR COMPOUND AND USE THEREOF MITSUI CHEMICALS INC (JP) 2006-12-27 EP disclosed
US-6570025-B1 Photopolymerization MITSUI CHEMICALS, INC. (JP) 2003-05-27 US disclosed
EP-1302471-A1 SULFUR COMPOUND AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-04-16 EP disclosed
EP-0724908-B1 Process for hydrogenating an aromatic ring containing compound using a ruthenium Raney catalyst SHOWA DENKO KK (JP) 2002-04-24 EP disclosed
US-6245920-B1 REACTING A 5-MEMBERED CYCLIC CARBOXYLIC ANHYDRIDE WITH HYDROGEN IN THE PRESENCE OF NOBLE METAL RANEY CATALYST TO REDUCE A CARBONYLOXY GROUP OF THE COMPOUND INTO A METHYLENEOXY GROUP TO CREATE A 5-MEMBERED LACTONE RING SHOWA DENKO K.K. (JP) 2001-06-12 US disclosed
US-6215030-B1 CATALYTIC REDUCTION OF ACIDS, ESTERS AND ANHYDRIDES TO ALCOHOLS SHOWA DENKO K.K. (JP) 2001-04-10 US disclosed
US-6018048-A PREPARING COMPOUNDS WITH HYDROGENATED RING STRUCTURE BY REACTING AN AROMATIC RING-CONTAINING COMPOUND WITH HYDROGEN IN THE PRESENCE OF A RANEY CATALYST COMPRISING AT LEAST 50% WEIGHT OF RUTHENIUM; MILDER TEMPERATURE, PRESSURE CONDITIONS SHOWA DENKO K.K. (JP) 2000-01-25 US disclosed
EP-0934920-A2 Preparation of hydrogenated compounds using noble metal Raney catalysts SHOWA DENKO KABUSHIKI KAISHA (JP) 1999-08-11 EP disclosed
EP-0724908-A1 Noble metal raney catalysts and preparation of hydrogenated compounds using such catalysts SHOWA DENKO KABUSHIKI KAISHA (JP) 1996-08-07 EP disclosed