SCHEMBL8977338

SCHEMBL8977338

Fc1ccc(-c2ccc([C@H]3CC[C@H](C4CC[Si](c5ccccc5)(c5ccccc5)CC4)CC3)cc2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
P2RY14 Q15391 1/20 0.33
DGAT1 O75907 6/20 0.31
KDM4E B2RXH2 1/20 0.30
FFAR2 O15552 1/20 0.30
SOAT2 O75908 1/20 0.30
KDM1A O60341 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL8977348 1.00 NPC1 (0.38) NPC1RAB9AP2RY14DGAT1KDM4E
SCHEMBL8977339 0.89 USP5 (0.34) KDM1A
SCHEMBL8977347 0.89 USP5 (0.34) KDM1A
SCHEMBL8944805 0.83 NPC1 (0.33) NPC1RAB9AKDM4E
SCHEMBL8944808 0.83 NPC1 (0.33) NPC1RAB9AKDM4E
SCHEMBL8944803 0.83 NPC1 (0.33) NPC1RAB9AKDM4E
SCHEMBL8768421 0.79 PGR (0.39) NPC1RAB9AP2RY14KDM4EKDM1A
SCHEMBL8768418 0.79 PGR (0.39) NPC1RAB9AP2RY14KDM4EKDM1A
SCHEMBL19850903 0.78 KMT2A (0.39) NPC1RAB9AP2RY14KDM1ACYP11B1
SCHEMBL8977320 0.78 NPC1 (0.41) NPC1RAB9A

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
US-5523439-A Process for preparing silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-06-04 US disclosed
EP-0696592-A1 Process for preparing silacyclohexane compounds SHIN-ETSU CHEMICAL CO., LTD. (JP) 1996-02-14 EP disclosed