SCHEMBL15526258

SCHEMBL15526258

CC1(C)OB(c2cccc(NC(=O)c3ccc(C4CC4)nc3)c2CO[Si](C)(C)C(C)(C)C)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 9/20 0.45
CXCR2 P25025 5/20 0.39
GABRA1 P14867 3/20 0.34
HDAC2 Q92769 1/20 0.34
PDE10A Q9Y233 1/20 0.32

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
SCHEMBL3705786 0.88 LIPE (0.42) LIPEHDAC2
SCHEMBL15525965 0.86 LIPE (0.46) LIPECXCR2HDAC2
SCHEMBL15607766 0.84 LIPE (0.43) LIPECXCR2GABRA1HDAC2PDE10A
SCHEMBL16343945 0.83 LIPE (0.47) LIPE
SCHEMBL15956659 0.82 LIPE (0.43) LIPECXCR2
SCHEMBL15956897 0.81 LIPE (0.43) LIPEHDAC2
SCHEMBL3720444 0.81 LIPE (0.46) LIPECXCR2
SCHEMBL3872642 0.81 LIPE (0.44) LIPECXCR2
SCHEMBL15957110 0.78 LIPE (0.45) LIPECXCR2
SCHEMBL106631 0.74 TAS1R3 (0.39) LIPE

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-2013157021-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LIMITED (IN) 2013-10-24 WO disclosed