SCHEMBL9314679

SCHEMBL9314679

CCOC(=O)C(CNCc1ccccc1)C(C)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
ATM Q13315 1/20 0.41
PPID Q08752 1/20 0.41
MMP8 P22894 2/20 0.38
EPHX2 P34913 1/20 0.38
PPARG P37231 1/20 0.38
MAPT P10636 3/20 0.37
NAMPT P43490 1/20 0.37
LMNA P02545 2/20 0.37
ELANE P08246 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
GAA P10253 1/20 0.37
APEX1 P27695 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PIN1 Q13526 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
SCHEMBL9695572 0.88 ATM (0.44) SMN1; SMN2ATMMAPTKDM4EALDH1A1
SCHEMBL9461991 0.77 MEN1 (0.44) ATMEPHX2KDM4EALDH1A1MEN1
SCHEMBL9462196 0.77 MEN1 (0.44) ATMEPHX2KDM4EALDH1A1MEN1
SCHEMBL2109163 0.76 MCHR1 (0.44) SMN1; SMN2ATMMAPTALDH1A1TDP1
SCHEMBL2112075 0.76 MCHR1 (0.44) SMN1; SMN2ATMMAPTALDH1A1TDP1
SCHEMBL9524914 0.75 SMN1; SMN2 (0.61) SMN1; SMN2ATMPPIDMMP8EPHX2
SCHEMBL8570991 0.74 ALDH1A1 (0.41) ATMMAPTELANEALDH1A1HSD17B10
SCHEMBL25346616 0.73 SMN1; SMN2 (0.63) SMN1; SMN2ATMPPIDMMP8EPHX2
SCHEMBL9805700 0.72 CPB2 (0.33) MMP8ALDH1A1
SCHEMBL9314368 0.72 CPB2 (0.33) MMP8ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5286721-A Antimicrobial agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-15 US disclosed
EP-0506982-A1 1-AZABICYCLO 3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed