SCHEMBL11349403

SCHEMBL11349403

C=C[Si](C)(C)c1ccc(CNOC(=O)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
MAPT P10636 1/20 0.38
BCHE P06276 1/20 0.36
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
CYP2D6 P10635 1/20 0.35
SRD5A1 P18405 1/20 0.35
SLC6A3 Q01959 2/20 0.35
SLC6A2 P23975 1/20 0.35
NR1H2 P55055 1/20 0.35

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
SCHEMBL27419910 0.79 ALDH1A1 (0.53) KMT2ATDP1SMN1; SMN2TSHRCA1
SCHEMBL22810886 0.78 SMN1; SMN2 (0.54) KMT2AMEN1TDP1SMN1; SMN2TSHR
SCHEMBL20214949 0.75 KMT2A (0.50) KMT2AMEN1TDP1CYP3A4SMN1; SMN2
Benzoic Acid SCHEMBL11349385 0.73 HPGD (0.41) SMN1; SMN2TSHRALDH1A1CYP2D6NR1H2
SCHEMBL15234456 0.72 TSHR (0.61) KMT2AMEN1TDP1CYP3A4L3MBTL1
SCHEMBL31495805 0.71 CES2 (0.45) KMT2AMEN1L3MBTL1SMN1; SMN2TSHR
SCHEMBL587284 0.70 KMT2A (0.50) KMT2AMEN1TDP1CYP3A4L3MBTL1
SCHEMBL8000103 0.69 NPC1 (0.56) KMT2ATDP1CYP3A4SMN1; SMN2TSHR
SCHEMBL27405685 0.69 VNN1 (0.53) KMT2AMEN1TDP1L3MBTL1SMN1; SMN2
SCHEMBL13560895 0.69 KMT2A (0.48) KMT2AMEN1TDP1L3MBTL1ALDH1A1

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-4301231-A SOLUBLE FILM FORMING POLYMER CONTAINING VINYL SILYL BRANCHES TORAY INDUSTRIES, INCORPORATED (JP) 1981-11-17 US disclosed