SCHEMBL7754484

SCHEMBL7754484

CCCc1ccc(C(=O)Oc2ccc(C3CC[SiH](CCC)CC3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
THRB P10828 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
KMT2A Q03164 3/20 0.42
PLA2G1B P04054 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
ALDH1A1 P00352 1/20 0.38
PRSS1 P07477 4/20 0.37
ACR P10323 2/20 0.37
F2 P00734 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
CYP2C9 P11712 1/20 0.36
TMPRSS2 O15393 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
SCHEMBL7754496 1.00 MAPT (0.43) MAPTTHRBSMN1; SMN2KMT2APLA2G1B
SCHEMBL7757034 1.00 MAPT (0.43) MAPTTHRBSMN1; SMN2KMT2APLA2G1B
SCHEMBL7757037 1.00 MAPT (0.43) MAPTTHRBSMN1; SMN2KMT2APLA2G1B
SCHEMBL7751084 0.92 MAPT (0.46) MAPTTHRBSMN1; SMN2
SCHEMBL7755488 0.92 MAPT (0.46) MAPTTHRBSMN1; SMN2
SCHEMBL7751083 0.92 MAPT (0.46) MAPTTHRBSMN1; SMN2
SCHEMBL7755486 0.92 MAPT (0.46) MAPTTHRBSMN1; SMN2
SCHEMBL7754699 0.88 MAPT (0.50) MAPTSMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL7754704 0.88 MAPT (0.50) MAPTSMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL7755541 0.87 KMT2A (0.44) MAPTSMN1; SMN2KMT2AALDH1A1CYP2C9

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