SCHEMBL7757096

SCHEMBL7757096

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
NPC1 O15118 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
DRD2 P14416 1/20 0.41
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MGLL Q99685 1/20 0.40
KMT2A Q03164 3/20 0.40
PRSS1 P07477 2/20 0.40
ACR P10323 2/20 0.40
GFER P55789 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL7757100 1.00 MAPT (0.47) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7754704 0.92 MAPT (0.50) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7754699 0.92 MAPT (0.50) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7755688 0.90 NPC1 (0.40) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7755692 0.90 NPC1 (0.40) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7755780 0.87 MGLL (0.44) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7755777 0.87 MGLL (0.44) MAPTSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL7753063 0.87 DRD2 (0.51) MAPTSMN1; SMN2ALDH1A1LMNADRD2
SCHEMBL7753058 0.87 DRD2 (0.51) MAPTSMN1; SMN2ALDH1A1LMNADRD2
SCHEMBL8452873 0.86 DRD2 (0.50) MAPTSMN1; SMN2ALDH1A1DRD2KMT2A

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 2 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
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