SCHEMBL14954530

SCHEMBL14954530

C=CCCC([SiH3])(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
ALDH1A1 P00352 4/20 0.40
HTT P42858 1/20 0.38
IDH1 O75874 1/20 0.35
KIF11 P52732 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 2/20 0.32
KCNN4 O15554 1/20 0.31
CYP2D6 P10635 1/20 0.31
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
OPRM1 P35372 1/20 0.31
DRD3 P35462 1/20 0.31
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TAAR1 Q96RJ0 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
SCHEMBL14954673 0.78 TSHR (0.52) TSHRALDH1A1HTTMAPK1KMT2A
SCHEMBL1974668 0.78 KIF11 (0.48) TSHRALDH1A1HTTKIF11MAPK1
SCHEMBL9888403 0.75 SMN1; SMN2 (0.48) TSHRALDH1A1HTTMAPK1CYP2D6
SCHEMBL27953401 0.75 TSHR (0.40) TSHRALDH1A1HTTIDH1KIF11
SCHEMBL10865897 0.75 TAAR1 (0.48) TSHRALDH1A1HTTMAPK1CYP2D6
SCHEMBL9317928 0.75 MAPK1 (0.41) TSHRALDH1A1HTTMAPK1KMT2A
SCHEMBL19419845 0.75 CYP1A2 (0.47) TSHRALDH1A1HTTKMT2ACYP2D6
SCHEMBL28661137 0.75 ALDH1A1 (0.37) TSHRALDH1A1HTTMAPK1
SCHEMBL7741027 0.73 TSHR (0.47) TSHRALDH1A1HTTIDH1KIF11
SCHEMBL4395774 0.73 TAAR1 (0.42) TSHRALDH1A1HTTKIF11MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822248-B2 Polysiloxane composition, hardened material and optical device KANEKA CORPORATION (JP) 2017-11-21 US disclosed
US-9688851-B2 Polysiloxane composition, hardened material and optical device KANEKA CORPORATION (JP) 2017-06-27 US disclosed
US-20150203677-A1 POLYSILOXANE COMPOSITION, HARDENED MATERIAL AND OPTICAL DEVICE KANEKA CORPORATION (JP) 2015-07-23 US disclosed
US-20130131264-A1 POLYSILOXANE COMPOSITION, HARDENED MATERIAL AND OPTICAL DEVICE KANEKA CORPORATION (JP) 2013-05-23 US disclosed