SCHEMBL8080646

SCHEMBL8080646

CCCC1CCC([C@H]2CC[C@H](C(S)c3ccc(OCC)c(F)c3F)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.30

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
SCHEMBL17997300 0.85 PDE2A (0.36) KDM1A
SCHEMBL25693810 0.81 PDE2A (0.39) KDM1A
SCHEMBL9561975 0.80 RIPK1 (0.39) KDM1A
SCHEMBL8448300 0.80 RIPK1 (0.39) KDM1A
SCHEMBL15445815 0.80 RIPK1 (0.39) KDM1A
SCHEMBL8448296 0.80 RIPK1 (0.39) KDM1A
SCHEMBL8448293 0.80 RIPK1 (0.39) KDM1A
SCHEMBL19167942 0.80 PDE2A (0.34)
SCHEMBL6520810 0.80 FFAR1 (0.37)
SCHEMBL10021049 0.80 L3MBTL1 (0.31)

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
JP-2000256307-A THIOETHER COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT HAVING NEGATIVE VALUE OF PERMITTIVITY ANISOTROPY CHISSO CORP 2000-09-19 JP disclosed