SCHEMBL6110232

SCHEMBL6110232

Cc1cccc(Cl)c1C(=O)C=Cc1ccc(C(=O)O)cc1-c1cccs1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 14/20 0.44
KDR P35968 3/20 0.40
SRPK1 Q96SB4 1/20 0.38
RPS6KB2 Q9UBS0 1/20 0.38

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
SCHEMBL6110903 0.93 TNFRSF1A (0.47) TNFRSF1ASRPK1RPS6KB2
SCHEMBL6110611 0.81 TNFRSF1A (0.67) TNFRSF1A
SCHEMBL6090580 0.77 POLB (0.38) SRPK1RPS6KB2
SCHEMBL6091074 0.76 AR (0.38) TNFRSF1ASRPK1RPS6KB2
SCHEMBL6040883 0.72 TNFRSF1A (0.61) TNFRSF1A
SCHEMBL6040888 0.72 TNFRSF1A (0.61) TNFRSF1A
SCHEMBL27142785 0.72 SRPK1 (0.50) SRPK1RPS6KB2
SCHEMBL6092865 0.70 AR (0.40) SRPK1RPS6KB2
SCHEMBL6092305 0.70 AR (0.42) TNFRSF1ASRPK1RPS6KB2
SCHEMBL30258436 0.67 SRPK1 (0.50) TNFRSF1ASRPK1RPS6KB2

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
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 WO claimed
WO-2006004903-A2 1,2-BIS-(SUBSTITUTED-PHENYL)-2-PROPEN-1-ONES AND PHARMACEUTICAL COMPOSITIONS THEREOF ATHEROGENICS, INC. (US) 2006-01-12 WO disclosed