SCHEMBL9468865

SCHEMBL9468865

CCCCCCCCCCCCCOCc1cccc(CO[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G4B P0C869 1/20 0.40
PLA2G2A P14555 1/20 0.37
GGPS1 O95749 2/20 0.36
DHFR P00374 7/20 0.36
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL9468724 0.89 L3MBTL1 (0.38) PLA2G4BTDP1L3MBTL1
SCHEMBL15155730 0.86 PPARG (0.47) DHFR
SCHEMBL11942311 0.79 IDO1 (0.38)
SCHEMBL31139336 0.77 IDO1 (0.33) TSHR
SCHEMBL649009 0.77 PLA2G4B (0.45) PLA2G4BTSHRTDP1L3MBTL1
SCHEMBL15155711 0.77 MAPK1 (0.43) TSHR
Fluoride Ion SCHEMBL31385474 0.77 DHFR (0.44) PLA2G4BGGPS1DHFRTSHR
SCHEMBL9479894 0.77 PLA2G4B (0.47) PLA2G4BGGPS1TSHRTDP1L3MBTL1
SCHEMBL9468805 0.77 PLA2G4B (0.44) PLA2G4BGGPS1TSHRTDP1L3MBTL1
SCHEMBL2560206 0.76 L3MBTL1 (0.47) TSHRTDP1L3MBTL1

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
US-5238832-A Lipoxygenase inhibitors BOARD OF GOVERNORS OF WAYNE STATE UNIVERSITY (US) 1993-08-24 US disclosed