Isophthalic Acid

Isophthalic Acid

SCHEMBL8440561

CCCCCCCCCCCCCCCCCC[N+](C)(C)C.O=C(O)c1cccc(C(=O)O)c1

nearest known ligand 0.65

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Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.51
PLA2G4B P0C869 1/20 0.50
PTPN11 Q06124 2/20 0.49
DNM1 Q05193 5/20 0.48
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
LTB4R Q15722 1/20 0.47

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 SCHEMBL8435022 1.00 PLA2G2A (0.51) PLA2G2APLA2G4BPTPN11DNM1TP53
Cetrimonium SCHEMBL8437264 1.00 PLA2G2A (0.51) PLA2G2APLA2G4BPTPN11DNM1TP53
Cetrimonium SCHEMBL8437266 0.93 PLA2G2A (0.46) PLA2G2APLA2G4BPTPN11DNM1TP53
Isophthalic Acid SCHEMBL11370519 0.93 PLA2G2A (0.46) PLA2G2APLA2G4BPTPN11DNM1TP53
Isophthalic Acid SCHEMBL8440562 0.93 PLA2G2A (0.46) PLA2G2APLA2G4BPTPN11DNM1TP53
Isophthalic Acid SCHEMBL8435024 0.93 PLA2G2A (0.46) PLA2G2APLA2G4BPTPN11DNM1TP53
Benzoic Acid SCHEMBL10590398 0.90 DNM1 (0.52) PLA2G4BDNM1TP53TSHR
Benzoic Acid SCHEMBL9012532 0.90 DNM1 (0.52) PLA2G4BDNM1TP53TSHR
Benzoic Acid SCHEMBL11374419 0.90 DNM1 (0.52) PLA2G4BDNM1TP53TSHR
Cetrimonium SCHEMBL4246682 0.89 DNM1 (0.53) PLA2G4BDNM1TP53TSHR

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-5933693-A Electroconductive elastic member and electrophotographic apparatus using same BRIDGESTONE CORPORATION (JP) 1999-08-03 US disclosed
US-4255553-A COMPRISING A COMPOUND HAVING AT LEAST TWO EPOXY GROUPS, A POLYESTER OR ACRYLIC RESIN, AND A QUARTERNARY AMMONIUM CARBOXYLATE AS CATALYST TOYO BOSEKI KABUSHIKI KAISHA (JP) 1981-03-10 US disclosed