Isophthalic Acid

Isophthalic Acid

SCHEMBL29014273

O=C(O)c1cccc(C(=O)O)c1.c1ccc(-c2ccccc2)cc1.c1ccc(-c2ccccc2)cc1

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.83
DAO P14920 1/20 0.62
TSHR P16473 1/20 0.62
NAPRT Q6XQN6 1/20 0.62
DHODH Q02127 2/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA6 P23280 1/20 0.60
CA9 Q16790 1/20 0.60
RXRA P19793 1/20 0.59
RXRB P28702 1/20 0.59
ATM Q13315 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
AKR1C3 P42330 1/20 0.57
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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 SCHEMBL721759 1.00 KMO (0.83) KMODAOTSHRNAPRTDHODH
Isophthalic Acid SCHEMBL3174195 1.00 KMO (0.83) KMODAOTSHRNAPRTDHODH
Terephthalic Acid SCHEMBL10664566 0.95 KMO (0.76) KMODAOTSHRNAPRTDHODH
SCHEMBL30436085 0.93 KMO (0.95) KMODAOTSHRNAPRTDHODH
SCHEMBL31752544 0.93 KMO (0.95) KMODAOTSHRNAPRTDHODH
SCHEMBL250880 0.93 KMO (0.95) KMODAOTSHRNAPRTDHODH
Hydrochloric Acid SCHEMBL30713416 0.91 KMO (0.91) KMODAOTSHRNAPRTDHODH
SCHEMBL3220396 0.91 KMO (0.91) KMODAOTSHRNAPRTDHODH
SCHEMBL28690696 0.91 KMO (0.91) KMODAOTSHRNAPRTDHODH
Biphenyl SCHEMBL9652651 0.91 KMO (0.91) KMODAOTSHRNAPRTDHODH

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
CN-116218219-B Wear-resistant self-lubricating composite material based on naphthyridine biphenyl polyarylether resin and preparation method thereof 大连保利新材料有限公司 2024-03-26 CN claimed
CN-116218219-A Wear-resistant self-lubricating composite material based on naphthyridine biphenyl polyarylether resin and preparation method thereof 大连保利新材料有限公司 2023-06-06 CN claimed