SCHEMBL9634722

SCHEMBL9634722

C=C[Si](C)(C)c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ACHE P22303 2/20 0.39
NPC1 O15118 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
ALDH1A1 P00352 3/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HDAC8 Q9BY41 1/20 0.30
CYP2A6 P11509 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
SCHEMBL3094174 0.85 NR1H2 (0.36) TSHRALDH1A1NR1H2NR1H3HDAC8
SCHEMBL1315461 0.78 TSHR (0.36) TSHRACHENPC1CASP3RAB9A
SCHEMBL1317648 0.76 TSHR (0.38) TSHRACHEALDH1A1CA1CA2
SCHEMBL1316336 0.76 TSHR (0.38) TSHRACHEALDH1A1CA1CA2
SCHEMBL11358166 0.76 ALDH1A1 (0.41) TSHRNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL9179552 0.76 ALDH1A1 (0.36) TSHRALDH1A1NR1H2NR1H3
SCHEMBL2558125 0.76 ALDH1A1 (0.38) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL1314012 0.72 TSHR (0.31) TSHRACHE
SCHEMBL7634333 0.72 LMNA (0.46) TSHRSMN1; SMN2ALDH1A1CA1CA2
SCHEMBL1315338 0.72 TSHR (0.35) TSHRACHENPC1RAB9ASMN1; SMN2

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
US-5147839-A Solid coordination catalyst containing hydrocarbyloxysilane and vinylalkylsilane components; stereospecific, selective MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1992-09-15 US disclosed