Isophthalic Acid

Isophthalic Acid

SCHEMBL11564174

O=C(O)c1cccc(C(=O)O)c1.O=C1OCC2CCCCC2COC(=O)c2ccc1cc2

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.48
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.41
APEX1 P27695 1/20 0.41
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA6 P23280 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 1/20 0.38

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 SCHEMBL692542 0.85 KMO (0.43) KMOPDE4APDE4BPDE4CPDE4D
SCHEMBL460145 0.82 MAPT (0.33) ALDH1A1HPGDMEN1KMT2AMAPT
Isophthalic Acid SCHEMBL472832 0.81 KMO (0.47) KMOALDH1A1HPGDKDM4EMEN1
Isophthalic Acid SCHEMBL2133440 0.80 KMO (0.46) KMOALDH1A1HPGDKDM4EMEN1
Isophthalic Acid SCHEMBL374460 0.80 KMO (0.46) KMOALDH1A1HPGDKDM4EMEN1
Isophthalic Acid SCHEMBL170729 0.79 KMO (0.48) KMOALDH1A1HPGDKDM4EMEN1
Isophthalic Acid SCHEMBL1401144 0.79 ALDH1A1 (0.50) KMOALDH1A1HPGDGAAHSD17B10
Isophthalic Acid SCHEMBL9282767 0.79 KMO (0.50) KMOPDE4APDE4BPDE4CPDE4D
Ethylene Glycol SCHEMBL487137 0.78 MEN1 (0.31) ALDH1A1MEN1KMT2AEPHX1
Isophthalic Acid SCHEMBL8500503 0.75 KMO (0.49) KMOMEN1KMT2ACA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4172075-A Fluoro-steroids and processes for their manufacture CIBA-GEIGY CORPORATION (US) 1979-10-23 US disclosed
US-3981237-A Plastic rotary printing screens construction method therefor RHODES JOHN M 1976-09-21 US disclosed