SCHEMBL8414209

SCHEMBL8414209

CC(C)(C)[Si](C)(C)OC[C@H]1[C@H]2CC(=O)O[C@H]2C[C@H]1OC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.71
▸ KDM4E B2RXH2 1/20 0.71
▸ NPC1 O15118 1/20 0.71
▸ SMN1; SMN2 Q16637 1/20 0.71
▸ TOP2A P11388 1/20 0.38
▸ BCHE P06276 1/20 0.36
▸ SENP1 Q9P0U3 1/20 0.36
▸ SCN1A P35498 1/20 0.35
▸ SCN2A Q99250 1/20 0.35
▸ SCN3A Q9NY46 1/20 0.35
▸ BACE1 P56817 4/20 0.34
▸ RNASE1 P07998 1/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33

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
SCHEMBL15198025 1.00 RAB9A (0.71) RAB9AKDM4ENPC1SMN1; SMN2TOP2A
SCHEMBL15192035 0.94 RAB9A (0.61) RAB9AKDM4ENPC1SMN1; SMN2TOP2A
SCHEMBL10987585 0.94 RAB9A (0.61) RAB9AKDM4ENPC1SMN1; SMN2TOP2A
SCHEMBL14953175 0.91 RAB9A (0.68) RAB9AKDM4ENPC1SMN1; SMN2TOP2A
SCHEMBL12013755 0.86 RAB9A (0.79) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL9212764 0.84 RAB9A (0.58) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL7159755 0.84 RAB9A (0.58) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL9216936 0.84 RAB9A (0.58) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL8413323 0.83 RAB9A (1.00) RAB9AKDM4ENPC1SMN1; SMN2BCHE
SCHEMBL15074495 0.83 RAB9A (1.00) RAB9AKDM4ENPC1SMN1; SMN2BCHE

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-0690049-B1 Agent for treating hepato biliary diseases R TECH UENO LTD (JP) 1999-08-04 — — EP disclosed
EP-0690049-A2 Agent for treating hepato biliary diseases R-TECH UENO LTD. (JP) 1996-01-03 — — EP disclosed
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