SCHEMBL16490334

SCHEMBL16490334

C[SiH](F)c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
NFE2L2 Q16236 2/20 0.33
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32
IDO1 P14902 1/20 0.32
ORAI1 Q96D31 1/20 0.32
ORAI2 Q96SN7 1/20 0.32
ORAI3 Q9BRQ5 1/20 0.32
TRPV6 Q9H1D0 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
APP P05067 1/20 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
SCHEMBL1835787 0.79 ACHE (0.45) ACHECA1CA2CA7CA9
Fluoride SCHEMBL27902343 0.77 ACHE (0.43) ACHECA1CA2CA7CA9
SCHEMBL8389519 0.74 ACHE (0.41) ACHECA1CA2CA7CA9
SCHEMBL3202384 0.73
SCHEMBL8656777 0.71 CA1 (0.42) ACHECA1CA2CA7CA9
SCHEMBL27897102 0.67 CA1 (0.38) ACHECA1CA2CA7CA9
Methylamine SCHEMBL27499302 0.66 ACHE (0.60) ACHECA1CA2CA7CA9
Methyl Alcohol SCHEMBL27383192 0.66 ACHE (0.60) ACHECA1CA2CA7CA9
Bromide SCHEMBL6770232 0.65
Fluoride SCHEMBL21816906 0.65 CA1 (0.57) ACHECA1CA2CA7CA9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434609-B2 Method for forming pattern, and polysiloxane composition JSR CORPORATION (JP) 2016-09-06 US disclosed
US-20150048046-A1 METHOD FOR FORMING PATTERN, AND POLYSILOXANE COMPOSITION JSR CORPORATION (JP) 2015-02-19 US disclosed