SCHEMBL8586706

SCHEMBL8586706

CC1(/C=C/CO)CCc2ccc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)cc21

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL8586713 1.00 SIGMAR1 (0.31) SIGMAR1
SCHEMBL8642502 0.94 SIGMAR1 (0.36) SIGMAR1
SCHEMBL8642508 0.94 SIGMAR1 (0.36) SIGMAR1
SCHEMBL8641584 0.87 KDM1A (0.34) SIGMAR1
SCHEMBL8589639 0.84 BACE1 (0.30)
SCHEMBL8589641 0.84 BACE1 (0.30)
SCHEMBL8615164 0.83 BACE1 (0.32) SIGMAR1
SCHEMBL8620702 0.81 CYP2C9 (0.34) SIGMAR1
SCHEMBL8636783 0.77 SIGMAR1 (0.39) SIGMAR1
SCHEMBL8612915 0.72 ABL1 (0.34) SIGMAR1

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-1998052913-A2 LEUKOTRIENE B4 ANTAGONISTS, IN PARTICULAR 3-OXA-TETRAHYDRONAPHTHALENE-LTB4 ANTAGONISTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-11-26 WO disclosed