Isophthalic Acid

Isophthalic Acid

SCHEMBL2801837

CCCN.O=C(O)c1cccc(C(=O)O)c1

nearest known ligand 0.59

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA6 P23280 1/20 0.52
CA9 Q16790 1/20 0.52
FOLH1 Q04609 1/20 0.50
NOS3 P29474 2/20 0.49
NOS1 P29475 2/20 0.49
NOS2 P35228 2/20 0.49
KIF11 P52732 1/20 0.49
ANPEP P15144 1/20 0.49
ENPEP Q07075 1/20 0.49
KMO O15229 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
UNG P13051 1/20 0.47
DAO P14920 1/20 0.46

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
Isophthalic Acid SCHEMBL27355603 0.90 KMT2A (0.51) KMT2ACA12CA1CA2CA6
Isophthalic Acid SCHEMBL1483205 0.89 KMT2A (0.61) KMT2ACA12CA1CA2CA6
Isophthalic Acid SCHEMBL29111376 0.89 PLA2G4B (0.50) KMT2AUNGTSHRTP53SMN1; SMN2
Octadecylamine SCHEMBL27647300 0.87 PLA2G4B (0.52) KMT2ATSHRTP53SMN1; SMN2
Benzoic Acid SCHEMBL1902823 0.87 TSHR (0.64) KMT2AHPGDHSD17B10DAOTSHR
Isophthalic Acid SCHEMBL9575080 0.87 CA12 (0.60) KMT2ACA12CA1CA2CA6
Benzoic Acid SCHEMBL11453164 0.85 TSHR (0.61) KMT2AHPGDHSD17B10DAOTSHR
Isophthalic Acid SCHEMBL11324134 0.85 KMT2A (0.58) KMT2ACA12CA1CA2CA6
Isophthalic Acid SCHEMBL27530757 0.85 KMT2A (0.58) KMT2ACA12CA1CA2CA6
Isophthalic Acid SCHEMBL6240907 0.84 CA12 (0.62) KMT2ACA12CA1CA2CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101247804-B chemical compound SMITHKLINE BEECHAM CORP 2012-09-26 CN disclosed
CN-101827840-A Imidazolidine-2,4-dione (hydantoin) derivatives useful as npy y2 receptor modulators NOVARTIS AG 2010-09-08 CN disclosed
US-RE41585-E1 Method for controlling the rheology of an aqueous fluid and gelling agent therefor AKZO NOBEL NV 2010-08-24 US disclosed
CN-101247804-A chemical compound SMITHKLINE BEECHAM CORP (US) 2008-08-20 CN disclosed
EP-1042425-B1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR AKZO NOBEL NV (NL) 2002-11-06 EP disclosed
US-6239183-B1 INJECTING VISCOELASTIC FLUID CONTAINING AMIDOAMINE OXIDE GELLING AGENT AND QUATERNARY AMMONIUM SALT OF AROMATIC DICARBOXYLIC ACID INTO SUBTERRANEAN FORMATION AKZO NOBEL NV (NL) 2001-05-29 US disclosed
EP-1042425-A1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR Akzo Nobel N.V. (NL) 2000-10-11 EP disclosed
WO-1999032572-A1 A METHOD FOR CONTROLLING THE RHEOLOGY OF AN AQUEOUS FLUID AND GELLING AGENT THEREFOR AKZO NOBEL N.V. (NL) 1999-07-01 WO disclosed