Isophthalic Acid

Isophthalic Acid

SCHEMBL21683231

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

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.58
PLA2G4B P0C869 3/20 0.57
RARB P10826 2/20 0.56
NR1H4 Q96RI1 3/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
PTPN11 Q06124 2/20 0.53
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
PLA2G2A P14555 1/20 0.51

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
SCHEMBL17698434 0.89 LMNA (0.51) KMT2APLA2G4BRARBNR1H4TSHR
SCHEMBL9052846 0.89 LMNA (0.51) KMT2APLA2G4BRARBNR1H4TSHR
Isophthalic Acid SCHEMBL5147832 0.89 KMT2A (0.58) KMT2APLA2G4BRARBNR1H4TP53
Benzoic Acid SCHEMBL19411715 0.89 RARB (0.64) PLA2G4BRARBTP53TSHR
Benzoic Acid SCHEMBL12981201 0.87 TSHR (0.62) PLA2G4BRARBTP53TSHRPLA2G2A
Isophthalic Acid SCHEMBL11324134 0.87 KMT2A (0.58) KMT2APLA2G4BNR1H4TP53TSHR
SCHEMBL16804661 0.86 PLA2G4B (0.55) KMT2APLA2G4BRARBNR1H4TP53
Benzoic Acid SCHEMBL136767 0.86 TP53 (0.65) PLA2G4BRARBTP53TSHRPLA2G2A
Benzoic Acid SCHEMBL28053122 0.86 TP53 (0.65) PLA2G4BRARBTP53TSHRPLA2G2A
SCHEMBL14093309 0.85 PLA2G4B (0.67) KMT2APLA2G4BTP53

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
EP-3833206-A1 MIDSOLE STRUCTURE OF AN ARTICLE OF FOOTWEAR INCLUDING MESH NIKE Innovate C.V. (US) 2021-06-16 EP disclosed
WO-2020033727-A1 MIDSOLE STRUCTURE OF AN ARTICLE OF FOOTWEAR INCLUDING MESH NIKE INNOVATE C.V. (US) 2020-02-13 WO disclosed