SCHEMBL7757222

SCHEMBL7757222

Clc1ccc(OCC2CC[SiH](Cl)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.44
PARP15 Q460N3 4/20 0.42
PARP10 Q53GL7 4/20 0.42
PARP2 Q9UGN5 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
ATF4 P18848 1/20 0.41

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
SCHEMBL7762082 0.91 PARP15 (0.42) LTA4HPARP15PARP10PARP2TDP1
SCHEMBL7762079 0.91 PARP15 (0.42) LTA4HPARP15PARP10PARP2TDP1
SCHEMBL7762077 0.91 PARP15 (0.42) LTA4HPARP15PARP10PARP2TDP1
SCHEMBL3667235 0.85 PARP15 (0.55) LTA4HPARP15PARP10PARP2TDP1
SCHEMBL7760269 0.85 SIGMAR1 (0.46)
SCHEMBL7760369 0.81 PARP10 (0.47) PARP15PARP10
SCHEMBL4186691 0.80 PARP15 (0.58) LTA4HPARP15PARP10PARP2
SCHEMBL7761393 0.79 PARP10 (0.45) PARP15PARP10ATF4
SCHEMBL3251238 0.77 TDP1 (0.68) LTA4HTDP1
SCHEMBL7763797 0.76 TDP1 (0.40) LTA4HTDP1

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