Phthalic Acid

Phthalic Acid

SCHEMBL11709147

O=C(O)CCCC(=O)O.O=C(O)CCCCC(=O)O.O=C(O)c1ccccc1C(=O)O.O=C(O)c1ccccc1C(=O)O

nearest known ligand 0.64

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Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

The experimentally established mechanism targets of Phthalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 known ✓ Q01959 1/20 0.54
ALDH1A1 P00352 5/20 0.64
ALOX15 P16050 1/20 0.64
HDAC8 Q9BY41 3/20 0.55
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
MAPT P10636 2/20 0.55
RXFP1 Q9HBX9 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
MAPK1 P28482 1/20 0.54
ADRA1A P35348 1/20 0.54
HPGD P15428 2/20 0.53

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 SCHEMBL30480760 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL1906918 0.98 ALDH1A1 (0.67) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Sebacic Acid SCHEMBL8362100 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL28433236 0.95 ALDH1A1 (0.64) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL10653166 0.91 ALDH1A1 (0.58) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL11906025 0.90 ALDH1A1 (0.56) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL4135702 0.90 GPR84 (0.58) ALDH1A1ALOX15HDAC8HDAC3HDAC4
Phthalic Acid SCHEMBL22217134 0.88 ALDH1A1 (0.74) ALDH1A1ALOX15HDAC8MAPTSMN1; SMN2
Phthalic Acid SCHEMBL125858 0.88 ALDH1A1 (0.74) ALDH1A1ALOX15HDAC8MAPTSMN1; SMN2
Phthalic Acid SCHEMBL6568928 0.88 AKR1B1 (0.61) ALDH1A1ALOX15HDAC11MAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4061612-A Low temperature plasticizers for specialty rubbers consisting of diesters of dicarboxylic acids with hexyloxyethoxyethanol or butoxyethoxyethoxyethanol THIOKOL CORPORATION (US) 1977-12-06 US disclosed