SCHEMBL7754677

SCHEMBL7754677

CCC[SiH]1CCC(c2ccc(OC(=O)c3ccc(Cl)cc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
IDO1 P14902 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 5/20 0.40
CCR6 P51684 1/20 0.40
LSS P48449 2/20 0.39
DRD2 P14416 1/20 0.39
HTT P42858 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
CCR1 P32246 1/20 0.37
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL7754681 1.00 KMT2A (0.44) KMT2AMEN1SMN1; SMN2IDO1ALDH1A1
SCHEMBL7755539 1.00 KMT2A (0.44) KMT2AMEN1SMN1; SMN2IDO1ALDH1A1
SCHEMBL7755541 1.00 KMT2A (0.44) KMT2AMEN1SMN1; SMN2IDO1ALDH1A1
SCHEMBL7754704 0.89 MAPT (0.50) KMT2ASMN1; SMN2ALDH1A1MAPTDRD2
SCHEMBL7754699 0.89 MAPT (0.50) KMT2ASMN1; SMN2ALDH1A1MAPTDRD2
SCHEMBL7757062 0.88 KMT2A (0.40) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7757066 0.88 KMT2A (0.40) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7754484 0.87 MAPT (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7754496 0.87 MAPT (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT
SCHEMBL7757034 0.87 MAPT (0.43) KMT2AMEN1SMN1; SMN2ALDH1A1MAPT

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
EP-0708107-B1 Novel silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHINETSU CHEMICAL CO (JP) 2001-02-28 EP disclosed
US-5624601-A Silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-04-29 US disclosed
EP-0708107-A1 Novel silacyclohexane compounds, a liquid crystal composition comprising the same and a liquid crystal device comprising the composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-04-24 EP disclosed