SCHEMBL1646865

SCHEMBL1646865

O=C(O)c1ccc(Cc2cc(C(=O)O)ccc2C(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.71
KDM4E B2RXH2 1/20 0.50
SRD5A2 P31213 3/20 0.49
ALDH1A1 P00352 2/20 0.48
RXRA P19793 2/20 0.48
PIM1 P11309 1/20 0.48
FOLH1 Q04609 1/20 0.46
TP53 P04637 1/20 0.46
PTPN1 P18031 2/20 0.45
PTPN2 P17706 1/20 0.45
PTPN6 P29350 1/20 0.45
KLKB1 P03952 1/20 0.44
CTSB P07858 1/20 0.44
MMP9 P14780 1/20 0.44
DNMT1 P26358 1/20 0.44
DNMT3B Q9UBC3 1/20 0.44
DNMT3L Q9UJW3 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 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
SCHEMBL7941034 0.91 TSHR (0.60) TSHRKDM4ESRD5A2ALDH1A1PIM1
SCHEMBL6772376 0.91 TSHR (0.69) TSHRKDM4ESRD5A2FOLH1PTPN1
SCHEMBL6653761 0.90 SRD5A2 (0.60) TSHRKDM4ESRD5A2ALDH1A1RXRA
SCHEMBL8579535 0.88 KDM4E (0.57) TSHRKDM4ESRD5A2ALDH1A1TP53
SCHEMBL69041 0.83 TSHR (1.00) TSHRKDM4ESRD5A2ALDH1A1FOLH1
SCHEMBL6887843 0.82 RARB (0.62) ALDH1A1
SCHEMBL6655375 0.82 RARB (0.62) ALDH1A1
SCHEMBL6889189 0.82 RARB (0.62) ALDH1A1
SCHEMBL6653950 0.82 TSHR (0.50) TSHRKDM4ESRD5A2ALDH1A1RXRA
SCHEMBL2428547 0.81 PLA2G2A (0.57) TSHRKDM4ESRD5A2PTPN1PTPN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180273463-A1 CATALYST HAVING A MODIFIED SILICON CARBIDE SUPPORT AND ITS USE AS A HYDROGENATION CATALYST UOP LLC (US) 2018-09-27 US claimed
US-8492583-B2 Hydrogenation using metal catalyst supported on heat, acid, abrasion and attrition resistant, high surface area silicon carbide support BP CORPORATION NORTH AMERICA INC. (US) 2013-07-23 US claimed
EP-1841724-B1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP CORP NORTH AMERICA INC (US) 2013-05-29 EP claimed
US-20080103333-A1 Process For Purification Of Aromatic Carboxylic Acids BP CORPORATION NORTH AMERICA INC. (US) 2008-05-01 US claimed
EP-1841724-A1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP Corporation North America Inc. (US) 2007-10-10 EP claimed
WO-2006071407-A1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP CORPORATION NORTH AMERICA INC. (US) 2006-07-06 WO claimed
US-4782181-A HYDROGENATION, CRYSTALLIZATION AMOCO CORPORATION (US) 1988-11-01 US claimed
US-20180273463-A1 CATALYST HAVING A MODIFIED SILICON CARBIDE SUPPORT AND ITS USE AS A HYDROGENATION CATALYST UOP LLC (US) 2018-09-27 US disclosed
WO-2017106298-A1 CATALYST HAVING A MODIFIED SILICON CARBIDE SUPPORT AND ITS USE AS A HYDROGENATION CATALYST UOP LLC (US) 2017-06-22 WO disclosed
US-8492583-B2 Hydrogenation using metal catalyst supported on heat, acid, abrasion and attrition resistant, high surface area silicon carbide support BP CORPORATION NORTH AMERICA INC. (US) 2013-07-23 US disclosed
EP-1841724-B1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP CORP NORTH AMERICA INC (US) 2013-05-29 EP disclosed
EP-2485999-A2 CATALYTIC HYDROGENATION OF CARBOXYARYLALDEHYDE AND USE THEREOF FOR PURIFYING CRUDE TEREPHTHALIC ACID BP Corporation North America Inc. (US) 2012-08-15 EP disclosed
US-20120178964-A1 Catalyst, Use Thereof and Process of Hydrogenating Aryl Aldehydes BP CORPORATION NORTH AMERICA INC (US) 2012-07-12 US disclosed
WO-2011041151-A2 CATALYST, USE THEREOF AND PROCESS FOR HYDROGENATING ARYL ALDEHYDES BP CORPORATION NORTH AMERICA INC. (US) 2011-04-07 WO disclosed
US-20080103333-A1 Process For Purification Of Aromatic Carboxylic Acids BP CORPORATION NORTH AMERICA INC. (US) 2008-05-01 US disclosed
EP-1841724-A1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP Corporation North America Inc. (US) 2007-10-10 EP disclosed
WO-2006071407-A1 PROCESS FOR PURIFICATION OF AROMATIC CARBOXYLIC ACIDS BP CORPORATION NORTH AMERICA INC. (US) 2006-07-06 WO disclosed
US-4782181-A HYDROGENATION, CRYSTALLIZATION AMOCO CORPORATION (US) 1988-11-01 US disclosed