SCHEMBL24834728

SCHEMBL24834728

C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@]13CC[C@](O)(CC[C@H]12)C3

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.61
PTPN1 P18031 3/20 0.60
PTPN2 P17706 1/20 0.60
CDC25B P30305 1/20 0.60
HSD11B1 P28845 2/20 0.58
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
KMT2A Q03164 1/20 0.45
SELP P16109 1/20 0.44
MMP2 P08253 1/20 0.41
CYP2C9 P11712 1/20 0.41
ATM Q13315 1/20 0.41
RPA1 P27694 2/20 0.39
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39

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
SCHEMBL22922196 0.84 F10 (0.66) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL22922186 0.84 F10 (0.66) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL29626878 0.84 F10 (0.66) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL25544876 0.84 F10 (0.43) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL13401724 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL24834731 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL21397914 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL24834650 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL22922183 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1
SCHEMBL21754703 0.80 F10 (0.60) F10PTPN1PTPN2CDC25BHSD11B1

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
US-20230000123-A1 SWEETENER AND FLAVOR COMPOSITIONS CONTAINING TERPENE GLYCOSIDES EPC Natural Products Co., Ltd (CN) 2023-01-05 US disclosed