Phthalic Anhydride

Phthalic Anhydride

SCHEMBL27770251

O=C(O)CCCCC(=O)O.O=C1OC(=O)c2ccccc21.OCCO.OCCOCCO

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

The experimentally established mechanism targets of Phthalic Anhydride. 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 0.39
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FFAR4 Q5NUL3 3/20 0.41
ACSL1 P33121 2/20 0.40
ACSL6 Q9UKU0 2/20 0.40
PPARA Q07869 2/20 0.40
HDAC3 O15379 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC7 Q8WUI4 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC10 Q969S8 2/20 0.40
HDAC11 Q96DB2 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC9 Q9UKV0 2/20 0.40
HDAC5 Q9UQL6 2/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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 Anhydride SCHEMBL28952608 0.98 ALOX15 (0.44) ALOX15TDP1FFAR4ACSL1ACSL6
Nonanoate SCHEMBL11749939 0.90 CDC25A (0.46) ALOX15TDP1FFAR4PPARAHDAC11
Phthalic Anhydride SCHEMBL28942215 0.89 FFAR4 (0.38) ALOX15TDP1FFAR4ACSL1ACSL6
Phthalic Anhydride SCHEMBL28323891 0.87 ALOX15 (0.56) ALOX15TDP1ALDH1A1MAPK1
Phthalic Anhydride SCHEMBL185274 0.85 ALOX15 (0.58) ALOX15TDP1ALDH1A1MAPK1
Phthalic Anhydride SCHEMBL6437106 0.85 ALOX15 (0.58) ALOX15TDP1HDAC3HDAC4HDAC1
Phthalic Anhydride SCHEMBL28312849 0.84 ALOX15 (0.56) ALOX15TDP1HDAC3HDAC4HDAC1
Sebacic Acid SCHEMBL4451750 0.84 TDP1 (0.56) ALOX15TDP1HDAC3HDAC4HDAC1
Phthalic Acid SCHEMBL28414620 0.80 ALDH1A1 (0.47) ALOX15FFAR4PPARAHDAC3HDAC4
Phthalic Anhydride SCHEMBL5943047 0.79 ALOX15 (0.50) ALOX15TDP1ALDH1A1MAPK1

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-101628963-B Bicomponent for manufacturing polyester polyurethane woodlike material XUCHUAN CHEMICAL SUZHOU CO LTD 2011-04-13 CN disclosed
CN-101628963-A Bicomponent for manufacturing polyester polyurethane woodlike material TAICANG XUCHUAN RESIN CO LTD 2010-01-20 CN disclosed