SCHEMBL6814538

SCHEMBL6814538

CCOc1c(-c2ccccc2)ccc(NC(=O)C2=C(C(=O)O)CCC2)c1F

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 19/20 0.53
NR4A2 P43354 7/20 0.52
NR4A1 P22736 2/20 0.50
JMJD7 P0C870 1/20 0.50
NR4A3 Q92570 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
FABP4 P15090 1/20 0.47
FABP5 Q01469 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
SCHEMBL6756236 0.90 DHODH (0.58) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL6859682 0.83 DHODH (0.64) DHODHNR4A2
SCHEMBL6754127 0.82 DHODH (0.59) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL7041288 0.80 DHODH (0.60) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL17415621 0.79 DHODH (0.54) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL6754645 0.77 DHODH (0.65) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL6754882 0.77 DHODH (0.62) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL6754115 0.77 DHODH (0.60) DHODHNR4A2FABP4FABP5
SCHEMBL6815996 0.77 DHODH (0.54) DHODHNR4A2NR4A1JMJD7NR4A3
SCHEMBL248162 0.76 DHODH (0.62) DHODHNR4A2NR4A1JMJD7NR4A3

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
WO-2003006425-A9 NOVEL COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS 4SC AG (DE) 2004-02-26 WO disclosed