SCHEMBL29906095

SCHEMBL29906095

C[C@H]1[C@@H](F)CN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.36
USP30 Q70CQ3 1/20 0.36
HPGD P15428 1/20 0.35
HSD11B1 P28845 1/20 0.35
TSHR P16473 1/20 0.34
CTSK P43235 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
SCHEMBL21227876 0.82 NR1H2 (0.42) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL27319966 0.82 NR1H2 (0.42) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL19985756 0.82 HSD17B10 (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL23537845 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL21576383 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL29132955 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL23537641 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL23537846 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL25790119 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2
SCHEMBL19471685 0.79 CHRM2 (0.43) NR1H2CHRM2CHRM1CHRM3USP2

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-2022211595-A1 OXADIAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 엘지화학 2022-10-06 WO disclosed