SCHEMBL7767580

SCHEMBL7767580

CCCCC[SiH]1CCC(CCCC[C@H]2CC[C@H](c3ccc(OCC(F)F)cc3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.35
CYP2C9 P11712 2/20 0.34
HRH3 Q9Y5N1 1/20 0.33
ITGB3 P05106 4/20 0.33
ITGA2B P08514 4/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CRBN Q96SW2 1/20 0.32
SPHK1 Q9NYA1 2/20 0.32
S1PR3 Q99500 1/20 0.32
ITGAV P06756 1/20 0.31
CHRM2 P08172 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL7767582 1.00 RAB9A (0.35) RAB9ACYP2C9HRH3ITGB3ITGA2B
SCHEMBL7767581 1.00 RAB9A (0.35) RAB9ACYP2C9HRH3ITGB3ITGA2B
SCHEMBL8455442 0.89 LMNA (0.36) RAB9ACYP2C9HRH3LMNAMAOA
SCHEMBL8455445 0.89 LMNA (0.36) RAB9ACYP2C9HRH3LMNAMAOA
SCHEMBL7767678 0.88 RAB9A (0.38) RAB9ACYP2C9HRH3LMNAMEN1
SCHEMBL7767675 0.88 RAB9A (0.38) RAB9ACYP2C9HRH3LMNAMEN1
SCHEMBL7767674 0.88 RAB9A (0.38) RAB9ACYP2C9HRH3LMNAMEN1
SCHEMBL9002301 0.87 LMNA (0.35) RAB9ACYP2C9HRH3LMNAMAOA
SCHEMBL9002307 0.87 LMNA (0.35) RAB9ACYP2C9HRH3LMNAMAOA
SCHEMBL7765353 0.86 RAB9A (0.40) RAB9ACYP2C9HRH3ITGB3ITGA2B

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-0727428-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-06-06 EP disclosed
US-5665271-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-09-09 US disclosed
EP-0727428-A1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-08-21 EP disclosed