SCHEMBL15925795

SCHEMBL15925795

COC(=O)NC1CC(C)(C)CC(C)(CNC(=O)C2COC(=O)O2)C1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.66
TDP1 Q9NUW8 1/20 0.34
HPGD P15428 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL15933759 0.93 TSHR (0.70) TSHRTDP1
SCHEMBL15074769 0.93 TSHR (0.54) TSHRTDP1HPGDRAB9A
SCHEMBL15933760 0.89 TSHR (0.52) TSHRTDP1
SCHEMBL19688992 0.87 TSHR (0.48) TSHRTDP1RAB9A
SCHEMBL22605131 0.84 TSHR (0.46) TSHRTDP1
SCHEMBL19688993 0.82 TSHR (0.52) TSHRTDP1HPGDRAB9A
SCHEMBL22627334 0.82 TSHR (0.86) TSHRTDP1
SCHEMBL1021081 0.80 TSHR (1.00) TSHRTDP1
SCHEMBL22627154 0.80 TSHR (0.82) TSHRTDP1
SCHEMBL19344489 0.79 TSHR (0.58) TSHRTDP1SMN1; SMN2

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
WO-2014118268-A1 2-OXO-1,3-DIOXOLANE-4-CARBOXAMIDE BUILDING BLOCKS, THEIR PREPARATION AND USE CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2014-08-07 WO disclosed
EP-2762471-A1 2-oxo-1,3-dioxolane-4-carboxamide building blocks, their preparation and use Construction Research & Technology GmbH (DE) 2014-08-06 EP disclosed