SCHEMBL3941545

SCHEMBL3941545

CCCCC1CC=CC(CCCC)(C(=O)O)C1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.38
ALOX5 P09917 1/20 0.32
POLB P06746 1/20 0.31
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL8993623 0.92 ALOX5 (0.39) SLC1A2ALOX5POLBALDH1A1
SCHEMBL8390825 0.85 ALOX5 (0.40) ALOX5POLBUSP2ALDH1A1
SCHEMBL3945153 0.75
SCHEMBL1471793 0.72 POLB (0.32) POLB
SCHEMBL3674324 0.71 CA2 (0.31)
SCHEMBL3941546 0.70 POLB (0.31) POLB
SCHEMBL8152353 0.65 HPSE (0.34) POLBALDH1A1
SCHEMBL3941543 0.63 ALOX5 (0.36) SLC1A2ALOX5POLBUSP2ALDH1A1
SCHEMBL14690083 0.63 CYP1A2 (0.39) ALOX5POLBALDH1A1
SCHEMBL27621644 0.62 AKR1B1 (0.31) USP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0815098-B1 PROCESS AND APPARATUS FOR THE PREPARATION AND RECOVERY OF MALEIC ANHYDRIDE HUNTSMAN SPEC CHEM CORP (US) 2004-04-21 EP claimed
EP-1385816-B1 METHOD FOR PURIFYING AN ORGANIC SOLVENT FOR THE PURPOSE OF ABSORPTION OF MALEIC ACID ANHYDRIDE BASF SE (DE) 2009-04-15 EP disclosed
EP-1385816-A1 METHOD FOR PURIFYING AN ORGANIC SOLVENT FOR THE PURPOSE OF ABSORPTION OF MALEIC ACID ANHYDRIDE BASF AKTIENGESELLSCHAFT (DE) 2004-02-04 EP disclosed
WO-2002085834-A1 METHOD FOR PURIFYING AN ORGANIC SOLVENT FOR THE PURPOSE OF ABSORPTION OF MALEIC ACID ANHYDRIDE BASF AKTIENGESELLSCHAFT (DE) 2002-10-31 WO disclosed