SCHEMBL25232248

SCHEMBL25232248

CC(C)(C)OC(=O)N1CCC2(CC2)C1O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.38
HPGD P15428 1/20 0.36
EPHX2 P34913 1/20 0.36
NR1H2 P55055 3/20 0.35
RXRA P19793 2/20 0.35
NR1H3 Q13133 2/20 0.35
ACACB O00763 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL25281230 0.93 HSD17B10 (0.39) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL25278431 0.93 HSD17B10 (0.39) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL25237769 0.92 HPGD (0.40) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL17031882 0.81 USP2 (0.38) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL15776522 0.80 HSD17B10 (0.42) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL17654997 0.80 HSD17B10 (0.42) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL25235086 0.80 USP2 (0.37) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL883204 0.80 HSD17B10 (0.42) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL17654998 0.79 USP2 (0.36) CHRM2CHRM1CHRM3USP2SMN1; SMN2
SCHEMBL17654999 0.79 USP2 (0.36) CHRM2CHRM1CHRM3USP2SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117677614-A Heterocyclic compound with AKT kinase inhibition activity, preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-03-08 CN disclosed
CN-116514817-A Heterocyclic compound with AKT kinase inhibition activity, preparation method and medical application thereof 中国医药研究开发中心有限公司 2023-08-01 CN disclosed
WO-2023109540-A1 HETEROCYCLIC COMPOUND WITH AKT KINASE INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2023-06-22 WO disclosed