SCHEMBL8620248

SCHEMBL8620248

CCC(=O)C/C=C(\C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
FFAR3 O14843 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CD81 P60033 1/20 0.32
PTGS1 P23219 1/20 0.31
AKR1C3 P42330 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
EP300 Q09472 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
SCHEMBL8620252 1.00 TDP1 (0.41) TDP1FFAR3ALDH1A1CD81PTGS1
SCHEMBL28111433 0.82 HDAC3 (0.39) FFAR3ALDH1A1CD81FNTAFNTB
SCHEMBL3683286 0.79 KDM4E (0.43) CD81PTGS1AKR1C3FNTAFNTB
SCHEMBL3683290 0.79 KDM4E (0.43) CD81PTGS1AKR1C3FNTAFNTB
SCHEMBL6834676 0.77 FNTA (0.36) CD81FNTAFNTB
SCHEMBL275071 0.77 ALDH1A1 (0.43) FFAR3ALDH1A1CD81PTGS1AKR1C3
SCHEMBL9445371 0.77
SCHEMBL474842 0.77 TRPA1 (0.38) TDP1FFAR3ALDH1A1CD81PTGS1
SCHEMBL2727259 0.77 ALDH1A1 (0.43) FFAR3ALDH1A1CD81PTGS1AKR1C3
SCHEMBL7138870 0.77 ALDH1A1 (0.43) FFAR3ALDH1A1CD81PTGS1AKR1C3

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-0463525-B1 Process for the manufacture of polymers of olefinically unsaturated monomers and solutions of polymers of olefinically unsaturated monomers BASF AG (DE) 1998-05-13 EP disclosed
EP-0463525-A1 Polymers of olefinically unsaturated monomers and solutions of polymers of olefinically unsaturated monomers BASF Aktiengesellschaft (DE) 1992-01-02 EP disclosed
EP-0288763-B1 AQUEOUS SECONDARY DISPERSIONS BASF Aktiengesellschaft (DE) 1991-05-15 EP disclosed
EP-0309842-A2 Process for the preparation of stable dispersions in aliphatic hydrocarbons, and their use BASF Aktiengesellschaft (DE) 1989-04-05 EP disclosed
EP-0288763-A2 Aqueous secondary dispersions BASF Aktiengesellschaft (DE) 1988-11-02 EP disclosed