SCHEMBL7523007

SCHEMBL7523007

NNC(=O)c1c(C(=O)O)ccc2ccc(O)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
GFER P55789 3/20 0.51
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
TSHR P16473 1/20 0.44
PTPN1 P18031 4/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
MPO P05164 1/20 0.41
CYP3A4 P08684 1/20 0.41
KDM5A P29375 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL7522996 0.90 ALDH1A1 (0.59) ALDH1A1GFERPTPN1MEN1KMT2A
SCHEMBL9645930 0.84 MAPT (0.48) ALDH1A1GFERPTPN1MEN1KMT2A
SCHEMBL5480836 0.81 WDR5 (0.56) ALDH1A1MEN1KMT2ACYP3A4HIF1A
SCHEMBL7258663 0.81 MYC (0.38) ALDH1A1GFERMEN1KMT2AKDM4E
SCHEMBL3966511 0.80 MYC (0.37) ALDH1A1GFERMEN1KMT2AKDM4E
SCHEMBL189571 0.80 SLC16A3 (0.44) ALDH1A1MEN1KMT2APTGS2CYP3A4
SCHEMBL29572861 0.80 SLC16A3 (0.44) ALDH1A1MEN1KMT2APTGS2CYP3A4
SCHEMBL998376 0.77 CYP1A2 (0.46) ALDH1A1GFERCA1CA2CA9
SCHEMBL712805 0.77 WDR5 (0.51) ALDH1A1TSHRMEN1KMT2ACYP3A4
SCHEMBL2678880 0.77 MYC (0.49) ALDH1A1GFERCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675968-B1 ENZYME-CATALYZED CHEMILUMINESCENT DETECTION OF PROTEINS AND NUCLEIC ACIDS USING HYDROXYARYL CYCLIC DIACYLHYDRAZIDE COMPOUNDS LUMIGEN INC (US) 2002-03-13 EP disclosed
EP-0675968-A4 ENZYME-CATALYZED CHEMILUMINESCENT DETECTION OF PROTEINS AND NUCLEIC ACIDS USING HYDROXYARYL CYCLIC DIACYLHYDRAZIDE COMPOUNDS. LUMIGEN INC (US) 1997-11-26 EP disclosed
US-5601977-A GENERATING CHEMILUMINESCENCE FROM OXIDATION OF CYCLIC DIACYLHYDRAZIDE DERIVATIVE BY ACTION OF PEROXIDASE ENZYME, A PEROXIDE OXIDIZER AND ENHANCER LUMIGEN, INC. (US) 1997-02-11 US disclosed
US-5552298-A Enzyme-catalyzed chemiluminescence from hydroxyaryl cyclic diacylhydrazide compounds LUMIGEN, INC. (US) 1996-09-03 US disclosed
EP-0675968-A1 ENZYME-CATALYZED CHEMILUMINESCENT DETECTION OF PROTEINS AND NUCLEIC ACIDS USING HYDROXYARYL CYCLIC DIACYLHYDRAZIDE COMPOUNDS LUMIGEN, INC. (US) 1995-10-11 EP disclosed
WO-1994014979-A1 ENZYME-CATALYZED CHEMILUMINESCENT DETECTION OF PROTEINS AND NUCLEIC ACIDS USING HYDROXYARYL CYCLIC DIACYLHYDRAZIDE COMPOUNDS LUMIGEN, INC. (US) 1994-07-07 WO disclosed
WO-1994010337-A1 ENZYME-CATALYZED CHEMILUMINESCENCE FROM HYDROXYARYL CYCLIC DIACYLHYDRAZIDE COMPOUNDS LUMIGEN, INC. (US) 1994-05-11 WO disclosed