SCHEMBL17895832

SCHEMBL17895832

COCc1nc2c(n1C)CCCc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.35
▸ LMNA P02545 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ GAA P10253 2/20 0.32
▸ HTT P42858 1/20 0.32
▸ PKM P14618 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL17896079 0.89 LMNA (0.35) USP2LMNAKDM4EGAAHTT
SCHEMBL17896017 0.88 LMNA (0.34) USP2LMNAKDM4EPKMALDH1A1
SCHEMBL17895978 0.83 LMNA (0.34) USP2LMNAKDM4EGAAHTT
SCHEMBL17895830 0.80 LMNA (0.32) USP2LMNAKDM4EPKMALDH1A1
SCHEMBL17895905 0.80 LMNA (0.34) USP2LMNAKDM4EGAAHTT
SCHEMBL17896121 0.79 LMNA (0.34) USP2LMNAKDM4EPKMALDH1A1
SCHEMBL17896034 0.79 LMNA (0.35) USP2LMNAKDM4EPKMALDH1A1
SCHEMBL17895829 0.79 MAPT (0.34) USP2LMNAKDM4EGAAHTT
SCHEMBL17895780 0.78 LMNA (0.34) USP2LMNAKDM4EPKMALDH1A1
SCHEMBL17896074 0.77 LMNA (0.32) LMNAKDM4EALDH1A1

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
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO claimed
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO disclosed
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