SCHEMBL15734673

SCHEMBL15734673

CC(C)[Si](O)(CCCc1cc(F)cc(F)c1)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.33
NOS3 P29474 2/20 0.31
NOS1 P29475 2/20 0.31
NOS2 P35228 1/20 0.31
DAO P14920 2/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRA6 Q16445 1/20 0.31
IDO1 P14902 1/20 0.31
AKR1B10 O60218 1/20 0.30
AKR1B1 P15121 1/20 0.30
CYP17A1 P05093 1/20 0.30
CYP21A2 P08686 1/20 0.30
CYP11B1 P15538 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
SCHEMBL15734719 0.95 TRPV1 (0.35) TRPV1NOS3NOS1NOS2DAO
SCHEMBL15738419 0.93 TRPV1 (0.34) TRPV1NOS3NOS1NOS2
SCHEMBL15738323 0.93 TRPV1 (0.34) TRPV1NOS3NOS1NOS2
SCHEMBL15734868 0.91 DAO (0.33) DAOIDO1CYP17A1CYP21A2CYP11B1
SCHEMBL15733835 0.84 NOS3 (0.31) NOS3NOS1NOS2GABRA1GABRB1
SCHEMBL15736830 0.83 TAAR1 (0.46) DAO
SCHEMBL15737761 0.82 TRPA1 (0.41)
SCHEMBL15734783 0.81 GCGR (0.33)
SCHEMBL15738089 0.79 PTGS2 (0.31) NOS3NOS1NOS2
SCHEMBL15735052 0.79 TAAR1 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10727410-B2 Surface modifier for transparent oxide electrode, surface-modified transparent oxide electrode, and method for producing surface-modified transparent oxide electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-28 US disclosed
EP-2738230-A1 Surface modifier for transparent oxide electrode, surface-modified transparent oxide electrode, and method for producing surface-modified transparent oxide electrode Shin-Etsu Chemical Co., Ltd. (JP) 2014-06-04 EP disclosed
US-20140147628-A1 Surface Modifier For Transparent Oxide Electrode, Surface-Modified Transparent Oxide Electrode, And Method For Producing Surface-Modified Transparent Oxide Electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-05-29 US disclosed