SCHEMBL7762590

SCHEMBL7762590

CCCCC[SiH]1CCC(CCCCc2ccc(Cl)c(F)c2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
SIGMAR1 Q99720 2/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
S1PR3 Q99500 1/20 0.34
PROKR1 Q8TCW9 3/20 0.33
FPR2 P25090 2/20 0.33
BCHE P06276 1/20 0.32
IGF1R P08069 1/20 0.32
ALOX15 P16050 1/20 0.32
HTR2A P28223 1/20 0.32
RARB P10826 2/20 0.32
RARA P10276 1/20 0.32
RARG P13631 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
S1PR1 P21453 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
SCHEMBL7762596 1.00 ITGB3 (0.36) ITGB3ITGA2BSIGMAR1CYP3A4CYP2C8
SCHEMBL7767709 0.94 ITGB3 (0.34) ITGB3ITGA2BSIGMAR1CYP3A4CYP2C8
SCHEMBL7767710 0.94 ITGB3 (0.34) ITGB3ITGA2BSIGMAR1CYP3A4CYP2C8
SCHEMBL7767708 0.94 ITGB3 (0.34) ITGB3ITGA2BSIGMAR1CYP3A4CYP2C8
SCHEMBL7766155 0.90 ITGB3 (0.37) ITGB3ITGA2BCYP3A4CYP2C8CYP2D6
SCHEMBL7766160 0.90 ITGB3 (0.37) ITGB3ITGA2BCYP3A4CYP2C8CYP2D6
SCHEMBL7765187 0.87 PROKR1 (0.32) SIGMAR1PROKR1FPR2IGF1RALOX15
SCHEMBL7765222 0.87 PROKR1 (0.32) SIGMAR1PROKR1FPR2IGF1RALOX15
SCHEMBL7765191 0.87 PROKR1 (0.32) SIGMAR1PROKR1FPR2IGF1RALOX15
SCHEMBL7769778 0.84 ITGB3 (0.34) ITGB3ITGA2BCYP3A4CYP2C8CYP2D6

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