SCHEMBL809324

SCHEMBL809324

O=C(O)c1ccc(C(=O)c2ccccc2)c(C(=O)O)c1C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.72
KDM4E B2RXH2 1/20 0.60
CDC25B P30305 2/20 0.57
CDC25A P30304 1/20 0.57
HSD17B10 Q99714 1/20 0.57
ATM Q13315 1/20 0.57
NR4A1 P22736 1/20 0.55
ALDH1A1 P00352 2/20 0.54
SRD5A2 P31213 1/20 0.52
MYC P01106 1/20 0.51
GAA P10253 2/20 0.50
MAPT P10636 1/20 0.50
CYP2C8 P10632 1/20 0.50
CYP2C9 P11712 1/20 0.50
POLB P06746 1/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50
KMT2A Q03164 1/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50

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
SCHEMBL6056938 0.98 AKR1C3 (0.69) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL6057040 0.98 AKR1C3 (0.69) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL144047 0.89 AKR1C3 (0.76) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL30978151 0.89 AKR1C3 (0.76) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL6056989 0.89 AKR1C3 (0.67) AKR1C3KDM4ECDC25BCDC25AHSD17B10
Hydrochloric Acid SCHEMBL10626938 0.88 AKR1C3 (0.73) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL1294741 0.87 SRD5A2 (0.58) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL31432550 0.87 AKR1C3 (0.72) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL28345543 0.86 AKR1C3 (0.55) AKR1C3KDM4ECDC25BCDC25AHSD17B10
SCHEMBL1666651 0.86 ALDH1A1 (0.65) AKR1C3KDM4EHSD17B10ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1890992-B1 AN ENRICHMENT PROCESS USING COMPOUNDS USEFUL IN A POLYESTER PROCESS GRUPO PETROTEMEX SA DE CV (MX) 2019-10-23 EP claimed
EP-3227261-B1 ESTER PLASTICIZERS BASED ON ETHYLHEXANOL AND PROPYLHEPTANOL EMERY OLEOCHEMICALS GMBH (DE) 2019-07-03 EP claimed
EP-1888497-B1 A PROCESS TO PRODUCE AN ENRICHED COMPOSITION THROUGH THE USE OF A CATALYST REMOVAL ZONE AND AN ENRICHMENT ZONE GRUPO PETROTEMEX SA DE CV (MX) 2019-04-17 EP claimed
EP-2066612-B1 A PROCESS TO PRODUCE AN ENRICHMENT FEED GRUPO PETROTEMEX SA DE CV (MX) 2018-08-01 EP claimed
US-20170313851-A1 ESTER PLASTICIZERS BASED ON ETHYLHEXANOL AND PROPYLHEPTANOL EMERY OLEOCHEMICALS GMBH (CH) 2017-11-02 US claimed
EP-1881953-B1 A PROCESS TO PRODUCE AN ENRICHED CARBOXYLIC ACID COMPOSITION GRUPO PETROTEMEX SA DE CV (MX) 2017-10-25 EP claimed
CN-107250098-A Ester plasticiser based on ethyl hexanol and propyl enanthol 埃默里油脂化学有限公司 2017-10-13 CN claimed
EP-3227261-A1 ESTER PLASTICIZERS BASED ON ETHYLHEXANOL AND PROPYLHEPTANOL Emery Oleochemicals GmbH (DE) 2017-10-11 EP claimed
WO-2016086977-A1 ESTER PLASTICIZERS BASED ON ETHYLHEXANOL AND PROPYLHEPTANOL AMRIL AG (CH) 2016-06-09 WO claimed
CN-105237385-A Versatile oxidation byproduct purge process GRUPO PETROTEMEX SA DE CV 2016-01-13 CN claimed
US-20060264664-A1 Esterification of an exchange solvent enriched composition EASTMAN CHEMICAL COMPANY 2006-11-23 US claimed
US-20060264657-A1 Process to enrich a carboxylic acid composition ALPEK POLYESTER, S.A. DE C.V. (MX) 2006-11-23 US claimed
US-20060264662-A1 Esterification of an enriched composition EASTMAN CHEMICAL COMPANY 2006-11-23 US claimed
US-20060264659-A1 Process to produce an enriched composition through the use of a catalyst removal zone and an enrichment zone ALPEK POLYESTER, S.A. DE C.V. (MX) 2006-11-23 US claimed
EP-0214103-B1 ADHESIVELY BONDED PHOTOSTRUCTURABLE POLYIMIDE FOIL CIBA-GEIGY AG (CH) 1990-06-27 EP claimed
US-4935320-A Substrate, thermostable adhesive, self-supporting, photocrosslinkable polyimide film CIBA-GEIGY CORPORATION (US) 1990-06-19 US claimed
US-4786569-A Adhesively bonded photostructurable polyimide film CIBA-GEIGY CORPORATION (US) 1988-11-22 US claimed
US-4008195-A POLYESTER NITTO ELECTRIC INDUSTRIAL CO., LTD. (JA) 1977-02-15 US claimed
US-4007146-A POLYESTER NITTO ELECTRIC INDUSTRIAL CO., LTD. (JA) 1977-02-08 US claimed
US-3936404-A Aqueous baking varnishes from carboxylic polyester and carboxylic polyimide, and coated article NITTO ELECTRIC INDUSTRIAL CO., LTD. (JA) 1976-02-03 US claimed