SCHEMBL7761368

SCHEMBL7761368

CCCCCCC[Si@H]1CC[C@H](COc2ccc(F)c(F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 6/20 0.40
PARP15 Q460N3 5/20 0.40
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR3A P46098 1/20 0.36
KCNH2 Q12809 1/20 0.36
SCN9A Q15858 2/20 0.35
FFAR4 Q5NUL3 2/20 0.35
CRBN Q96SW2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM1A O60341 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL7761363 1.00 PARP10 (0.40) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7760350 0.99 PARP10 (0.41) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7760352 0.99 PARP10 (0.41) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7757294 0.92 PARP10 (0.38) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7757286 0.92 PARP10 (0.38) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7757290 0.92 PARP10 (0.38) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7757213 0.90 PARP10 (0.38) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7757209 0.90 PARP10 (0.38) PARP10PARP15SLC6A2SLC6A4HTR3A
SCHEMBL7760411 0.88 PARP10 (0.34) PARP10PARP15SCN9AFFAR4TDP1
SCHEMBL7760416 0.88 PARP10 (0.34) PARP10PARP15SCN9AFFAR4TDP1

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-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
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