Phthalic Acid

Phthalic Acid

SCHEMBL9045371

O=C(O)c1ccccc1C(=O)O.OCC(CO)(CO)CO.OCC(CO)(CO)CO

nearest known ligand 0.67

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
ALOX15 P16050 1/20 0.67
AKR1C3 P42330 1/20 0.52
KDM4E B2RXH2 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
HMGB1 P09429 1/20 0.50
HPGD P15428 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA7 P43166 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CA9 Q16790 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
CA14 Q9ULX7 1/20 0.50
MAPT P10636 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
KMT2A Q03164 1/20 0.47
MYC P01106 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
Phthalic Acid SCHEMBL28891019 1.00 ALDH1A1 (0.67) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL8423227 1.00 ALDH1A1 (0.67) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL29542228 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL26112783 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL2454741 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL235415 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL234469 0.88 ALDH1A1 (0.52) ALDH1A1ALOX15AKR1C3KDM4ECA12
Phthalic Acid SCHEMBL9042493 0.87 ALDH1A1 (0.56) ALDH1A1ALOX15AKR1C3KDM4ECA12
Salicylic Acid SCHEMBL10537057 0.87 ALDH1A1 (0.72) ALDH1A1ALOX15KDM4ECA12CA1
Phthalic Acid SCHEMBL11223424 0.87 ALDH1A1 (0.56) ALDH1A1ALOX15AKR1C3KDM4ECA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497552-B1 Photopolymerisable compositions NAT STARCH CHEM INVEST (US) 1996-05-22 EP disclosed
US-5445918-A Using a photoiniator of a titanocene compound and N-phenyl glycine to polymerize and unsaturated compound; photosensitity; UV and visible radiation ZENECA LIMITED (GB) 1995-08-29 US disclosed
EP-0497552-A1 Photopolymerisable compositions National Starch and Chemical Investment Holding Corporation (US) 1992-08-05 EP disclosed
US-4202806-A HEAT STABILIZERS KOEI CHEMICAL CO., LTD. (JP) 1980-05-13 US disclosed
US-4134868-A Aromatic carboxylic acid ester stabilizers for PVC resins ARGUS CHEMICAL CORPORATION (US) 1979-01-16 US disclosed