SCHEMBL7762082

SCHEMBL7762082

Clc1ccc(OCC2CCC(C3CC[SiH](Cl)CC3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 1/20 0.42
PARP10 Q53GL7 1/20 0.42
PARP2 Q9UGN5 1/20 0.42
LTA4H P09960 4/20 0.40
ATF4 P18848 1/20 0.40
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7762079 1.00 PARP15 (0.42) PARP15PARP10PARP2LTA4HATF4
SCHEMBL7762077 1.00 PARP15 (0.42) PARP15PARP10PARP2LTA4HATF4
SCHEMBL7757222 0.91 LTA4H (0.44) PARP15PARP10PARP2LTA4HATF4
SCHEMBL3667235 0.83 PARP15 (0.55) PARP15PARP10PARP2LTA4HATF4
SCHEMBL7757312 0.83 PARP10 (0.43) PARP15PARP10
SCHEMBL7757316 0.83 PARP10 (0.43) PARP15PARP10
SCHEMBL7757324 0.83 PARP10 (0.43) PARP15PARP10
SCHEMBL7763787 0.81 PARP10 (0.41) PARP15PARP10ATF4
SCHEMBL7763793 0.81 PARP10 (0.41) PARP15PARP10ATF4
SCHEMBL7763800 0.81 PARP10 (0.41) PARP15PARP10ATF4

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-0714899-B1 Novel silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHINETSU CHEMICAL CO (JP) 2001-04-18 EP disclosed
US-5641430-A Silacyclohexane compounds, preparation thereof, liquid crystal compositions comprising the same, and liquid crystal devices comprising the compositions SHIN-ETSU CHEMICAL CO., LTD. (JP) 1997-06-24 US disclosed
EP-0714899-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) 1996-06-05 EP disclosed