SCHEMBL24251931

SCHEMBL24251931

COCC1CC(OC)CN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.40
UCHL1 P09936 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ABCB1 P08183 1/20 0.35
PDE4B Q07343 1/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD11B1 P28845 1/20 0.33
AR P10275 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
SCHEMBL21770659 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL29246157 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL29231967 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL1604238 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL19181227 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL13163960 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL1584687 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL7918399 0.88 NR1H2 (0.47) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL19179977 0.88 UCHL1 (0.36) NR1H2UCHL1CHRM2CHRM1CHRM3
SCHEMBL23419844 0.88 NR1H2 (0.36) NR1H2UCHL1CHRM2CHRM1CHRM3

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-2022033532-A1 FGFR AND MUTATION INHIBITOR THEREOF, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海和誉生物医药科技有限公司 2022-02-17 WO disclosed