SCHEMBL10608600

SCHEMBL10608600

CCC(=O)C(C(=O)OC)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP8 P22894 1/20 0.57
▸ KMT2A Q03164 5/20 0.56
▸ ALDH1A1 P00352 4/20 0.46
▸ GLS O94925 2/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ SRC P12931 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ LMNA P02545 2/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ HPGD P15428 1/20 0.42

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
SCHEMBL957814 0.89 MMP8 (0.66) MMP8KMT2AALDH1A1MEN1SRC
SCHEMBL10610733 0.86 MMP8 (0.54) MMP8KMT2AALDH1A1GLSMEN1
SCHEMBL9247708 0.85 SRC (0.56) MMP8KMT2AALDH1A1MEN1SRC
SCHEMBL3598733 0.85 KMT2A (0.69) MMP8KMT2AALDH1A1GLSMEN1
SCHEMBL27454774 0.84 KMT2A (0.55) MMP8KMT2AALDH1A1GLSMEN1
SCHEMBL28474562 0.84 MMP8 (0.73) MMP8KMT2AALDH1A1GLSMEN1
SCHEMBL12561192 0.83 MMP8 (0.51) MMP8KMT2AGLSMEN1NPC1
SCHEMBL10605814 0.83 ALDH1A1 (0.51) MMP8ALDH1A1SRCCYP1A2SMN1; SMN2
SCHEMBL12727132 0.83 RAB9A (0.44) KMT2AALDH1A1MEN1CA1CA2
SCHEMBL10605959 0.83 ATM (0.53) MMP8KMT2AALDH1A1MEN1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102924201-A Method for preparing perfluoroalkyl alkyl ketone compound UNIV DALIAN TECH 2013-02-13 — — CN disclosed
EP-0114059-B1 METHOD OF PREPARING A POLYAMIDE ACID COMPOSITION FOR PREPARING POLYIMIDE KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-06-14 — — EP disclosed
US-4515915-A Polyamide acid composition for preparing polyimide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-07 — — US disclosed
EP-0114059-A2 Method of preparing a polyamide acid composition for preparing polyimide KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1984-07-25 — — EP disclosed
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