SCHEMBL8205840

SCHEMBL8205840

COC(=O)[C@H]1CCC(OC)N1C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
EPHX1 P07099 1/20 0.38
PREP P48147 4/20 0.37
PTPN1 P18031 2/20 0.36
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
HPGD P15428 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PDE4B Q07343 1/20 0.33
FKBP1A P62942 1/20 0.33
HSD11B1 P28845 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PTPN2 P17706 1/20 0.33
PTPN6 P29350 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL5832813 1.00 CHRM2 (0.44) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL12328185 1.00 CHRM2 (0.44) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL14714350 0.92 CHRM2 (0.45) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL15635071 0.92 CHRM2 (0.45) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL14724992 0.92 CHRM2 (0.45) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL25867319 0.91 EPHX1 (0.43) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL1606040 0.91 EPHX1 (0.43) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL1606041 0.91 EPHX1 (0.43) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL22086379 0.89 CHRM2 (0.50) CHRM2CHRM1CHRM3EPHX1PREP
SCHEMBL17040995 0.89 CHRM2 (0.50) CHRM2CHRM1CHRM3EPHX1PREP

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024234360-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS , INC. (US) 2024-11-21 WO disclosed
WO-2024200777-A1 SUBSTITUTED HYDROXYMETHYL PYRROLIDINES FOR USE IN THE TREATMENT OF HYPERGLYCAEMIA AND DISORDERS CHARACTERISED BY HYPERGLYCAEMIA ATROGI AB (SE) 2024-10-03 WO disclosed
WO-2024197503-A1 TRICYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS , INC. (US) 2024-10-03 WO disclosed
WO-2024159471-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS , INC. (US) 2024-08-08 WO disclosed
WO-2024159470-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS , INC. (US) 2024-08-08 WO disclosed
WO-2024160225-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2024-08-08 WO disclosed
WO-2024149214-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING KRAS-12D VIA UBIQUITIN PROTEASOME PATHWAY NIKANG THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed
WO-2024138486-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2024-07-04 WO disclosed
WO-2024091409-A1 TRICYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2024-05-02 WO disclosed
WO-2024051721-A1 TETRACYCLIC DERIVATIVES AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2024-03-14 WO disclosed
WO-2024045066-A1 ALKYLIDENE CARBAMATE AS KRAS INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2024-03-07 WO disclosed
WO-2008046527-A1 ACYLAMINOPYRAZOLES FOR TREATING CARDIOVASCULAR DISEASES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-04-24 WO disclosed
WO-2008043533-A2 ACYL AMINOIMIDAZOLES AND ACYL AMINOTHIAZOLES BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-04-17 WO disclosed
WO-2007082666-A1 ACYLAMINOIMIDAZOLES BAYER HEALTHCARE AG (DE) 2007-07-26 WO disclosed