SCHEMBL31380287

SCHEMBL31380287

COC(=O)C=Cc1cccc(C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.58
▸ APP P05067 1/20 0.58
▸ PTPN1 P18031 1/20 0.55
▸ MAOA P21397 2/20 0.55
▸ MAOB P27338 2/20 0.55
▸ MMP1 P03956 3/20 0.55
▸ MMP2 P08253 3/20 0.55
▸ MMP9 P14780 3/20 0.55
▸ CA12 O43570 1/20 0.54
▸ CA1 P00915 1/20 0.54
▸ CA2 P00918 1/20 0.54
▸ TYR P14679 1/20 0.54
▸ CA7 P43166 1/20 0.54
▸ CA9 Q16790 1/20 0.54
▸ CA14 Q9ULX7 1/20 0.54
▸ EPHX2 P34913 1/20 0.54
▸ KDM4E B2RXH2 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ JAK2 O60674 1/20 0.53

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
SCHEMBL2614742 1.00 TTR (0.58) TTRAPPPTPN1MAOAMAOB
SCHEMBL13256239 1.00 TTR (0.58) TTRAPPPTPN1MAOAMAOB
SCHEMBL4084338 1.00 TTR (0.58) TTRAPPPTPN1MAOAMAOB
SCHEMBL69618 0.89 TTR (0.66) TTRAPPPTPN1CA12CA1
SCHEMBL3065424 0.84 CA12 (0.66) TTRAPPPTPN1MMP1MMP2
SCHEMBL30676338 0.84 CA12 (0.66) TTRAPPPTPN1MMP1MMP2
SCHEMBL2631340 0.84 CA12 (0.66) TTRAPPPTPN1MMP1MMP2
SCHEMBL1269501 0.83 TTR (0.63) TTRMAOAMAOBMMP1MMP2
SCHEMBL1269502 0.83 TTR (0.63) TTRMAOAMAOBMMP1MMP2
SCHEMBL2280675 0.83 TTR (0.58) TTRAPPPTPN1CA12CA1

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
CN-119490449-A Hydroxamic acid compound containing N-benzyl-2- (5-phenylpyridin-2-yl) acetamide and preparation method and application thereof 沈阳药科大学 2025-02-21 — — CN disclosed
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