SCHEMBL7919934

SCHEMBL7919934

CCCCCC(C)(CCCCC)/N=C(\N)SC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
FDPS P14324 3/20 0.33
SMPD1 P17405 4/20 0.32
CYP2C19 P33261 1/20 0.31
THPO P40225 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
GGPS1 O95749 2/20 0.31
LMNA P02545 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
SCHEMBL22010421 0.78 MEN1 (0.50) MEN1KMT2AFDPSSMPD1GGPS1
SCHEMBL24401029 0.78 MEN1 (0.50) MEN1KMT2AFDPSSMPD1GGPS1
SCHEMBL22951430 0.69 FDPS (0.33) FDPSSMPD1GGPS1
SCHEMBL22955304 0.68 EPHX1 (0.31) FDPSGGPS1
Iodide SCHEMBL11685953 0.67 NOS1 (0.50) MEN1KMT2ACYP2C19THPONOS3
SCHEMBL22666450 0.67 GGPS1 (0.35) MEN1KMT2AFDPSSMPD1GGPS1
SCHEMBL25766806 0.67 GGPS1 (0.35) MEN1KMT2AFDPSSMPD1GGPS1
SCHEMBL22021840 0.67 GGPS1 (0.35) MEN1KMT2AFDPSSMPD1GGPS1
SCHEMBL23505664 0.67
SCHEMBL18793246 0.63 GGPS1 (0.38) FDPSSMPD1GGPS1

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-2010098488-A1 ARYL IMIDAZOLE COMPOUNDS AND THEIR USE AS BETA AMYLOID PRODUCTION INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-09-02 WO disclosed