SCHEMBL10695758

SCHEMBL10695758

CC(C)(C)c1ccc(CC2CCCCN2[Si](C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.41
HRH1 P35367 1/20 0.38
TEAD1 P28347 2/20 0.38
DAGLA Q9Y4D2 5/20 0.37
ABHD6 Q9BV23 3/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
XBP1 P17861 1/20 0.36
ALOX12 P18054 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL10694540 0.96 HRH1 (0.41) SIGMAR1HRH1TEAD1ALDH1A1SMN1; SMN2
SCHEMBL10693222 0.82 KCNH2 (0.35) DAGLAKCNH2
SCHEMBL8376783 0.67 KMT2A (0.39) ALDH1A1LMNAHPGDNPSR1
SCHEMBL13165310 0.66 SIGMAR1 (0.48) SIGMAR1KCNH2
SCHEMBL3549526 0.66 HSD11B1 (0.69) SIGMAR1ALDH1A1
SCHEMBL20314564 0.65 SIGMAR1 (0.43) SIGMAR1KCNH2
SCHEMBL25258805 0.64 TSHR (0.43) SIGMAR1ALDH1A1HPGDKCNH2
SCHEMBL10212101 0.64 HRH3 (0.65) SIGMAR1ALDH1A1KCNH2
SCHEMBL21732238 0.64 ALDH1A1 (0.38) ALDH1A1KCNH2
SCHEMBL9359971 0.64 ADRA2A (0.41) SIGMAR1TEAD1KCNH2

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-0241429-A2 Microbicidal silanes CIBA-GEIGY AG (CH) 1987-10-14 EP claimed
US-4762826-A FUNGICIDES FOR PLANTS CIBA-GEIGY CORPORATION (US) 1988-08-09 US disclosed
EP-0241429-A2 Microbicidal silanes CIBA-GEIGY AG (CH) 1987-10-14 EP disclosed