SCHEMBL9547222

SCHEMBL9547222

CC(C)(C)OC(=O)N(CCC#N)CCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.35
TSHR P16473 1/20 0.33
CTSD P07339 1/20 0.30
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
MLYCD O95822 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
SCHEMBL1965746 0.83 SSTR4 (0.41) CA14
SCHEMBL15891326 0.82 CA14 (0.37) CA14
SCHEMBL2172676 0.81 CA14 (0.35) CA14
SCHEMBL19560799 0.81 CA14 (0.39) CA14
SCHEMBL30511000 0.80 CA14 (0.41) CA14
SCHEMBL30510997 0.80 CA14 (0.41) CA14
SCHEMBL1143162 0.80 CA14 (0.33) CA14
SCHEMBL14832112 0.80 CA14 (0.41) CA14
SCHEMBL17083335 0.79 CA14 (0.51) CA14TSHRCTSDCTSLCTSB
SCHEMBL25180272 0.78 CA14 (0.35) CA14

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
WO-1993023402-A1 3-AZETIDINYLTHIO-CARBAPENEME DERIVATIVES, THEIR PREPARATION AND USE AS ANTIMICROBIAL AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-25 WO disclosed