SCHEMBL29035448

SCHEMBL29035448

CC(C)(C)OC(=O)N1CC(C2CCCC2)C[C@H]1CO

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.51
SRC P12931 8/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
EPHX1 P07099 1/20 0.36
NR1H3 Q13133 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PREP P48147 1/20 0.36

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
SCHEMBL29007981 0.97 NR1H2 (0.51) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL30700528 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL16584744 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL261611 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL610130 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL19390033 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL13336742 0.90 NR1H2 (0.55) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL6853781 0.85 NR1H2 (0.48) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL6853768 0.85 NR1H2 (0.48) NR1H2SRCCHRM2CHRM1CHRM3
SCHEMBL21429615 0.81 NR1H2 (0.46) NR1H2SRCCHRM2CHRM1CHRM3

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
EP-4216946-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS Achillion Pharmaceuticals, Inc. (US) 2023-08-02 EP disclosed
CN-116437913-A Pharmaceutical compounds for treating complement-mediated disorders 艾其林医药公司 2023-07-14 CN disclosed
WO-2022066774-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2022-03-31 WO disclosed