SCHEMBL9805556

SCHEMBL9805556

COc1ccc(CN2C[C@H]([C@@H](C)C(C)(C)C(O[SiH2]C)O[SiH2]C)C2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ GRM2 Q14416 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MMP1 P03956 1/20 0.40
▸ MMP13 P45452 1/20 0.40
▸ GSK3A P49840 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ TACR1 P25103 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CMA1 P23946 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ MAPK1 P28482 1/20 0.37

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
SCHEMBL9462348 0.74 GRM2 (0.46) GAAALDH1A1GRM2MMP1MMP13
SCHEMBL9462353 0.74 GRM2 (0.46) GAAALDH1A1GRM2MMP1MMP13
SCHEMBL10277306 0.68 MMP1 (0.58) GAAALDH1A1GRM2LMNAMMP1
SCHEMBL10277302 0.68 MMP1 (0.58) GAAALDH1A1GRM2LMNAMMP1
SCHEMBL16181409 0.67 CMA1 (0.49) GAAALDH1A1GRM2LMNAMMP1
SCHEMBL10308891 0.66 GRM2 (0.50) GAAALDH1A1GRM2LMNAMMP1
SCHEMBL21262113 0.66 GAA (0.51) GAAALDH1A1GRM2LMNAMMP1
SCHEMBL17897282 0.65 ALDH1A1 (0.52) GAAALDH1A1GRM2LMNAGSK3A
SCHEMBL15400067 0.65 GRM2 (0.52) GAAALDH1A1GRM2MMP1MMP13
SCHEMBL15958461 0.65 GRM2 (0.52) GAAALDH1A1GRM2MMP1MMP13

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
EP-0421283-A2 A new process for preparing optically active 3-substituted azetidinones FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-04-10 — — EP disclosed
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