SCHEMBL2076540

SCHEMBL2076540

CC(C)(C)N(C(=O)O)[C@@H](c1nccs1)[C@@H](CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSA P10619 4/20 0.32
LMNA P02545 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL4342553 0.79 NPC1 (0.34) CTSANPC1RAB9A
SCHEMBL21962291 0.73 CA2 (0.35)
SCHEMBL2078456 0.73
SCHEMBL2078460 0.73
SCHEMBL21962093 0.72 CTSA (0.32) CTSANPC1RAB9A
SCHEMBL2077245 0.70
SCHEMBL2077248 0.70
SCHEMBL4342560 0.68 CTSA (0.32) CTSALMNANPC1RAB9A
SCHEMBL2078473 0.68 TBXAS1 (0.33) RAB9A
SCHEMBL2078476 0.68 TBXAS1 (0.33) RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163909-B2 Substituted hydroxyethyl amine compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2012-04-24 US disclosed