SCHEMBL17895939

SCHEMBL17895939

Cc1c2c(nn1C)-c1[nH]c(=O)c(C(=O)O)c(O)c1CCC2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 5/20 0.36
▸ LMNA P02545 1/20 0.36
▸ USP2 O75604 1/20 0.35
▸ SPR P35270 1/20 0.34
▸ POLB P06746 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ KDM4E B2RXH2 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL17895978 0.79 LMNA (0.34) PARP1LMNAUSP2SPRPOLB
SCHEMBL17895874 0.78 LMNA (0.37) LMNAUSP2SPRPOLBMAPT
SCHEMBL17896050 0.75 LMNA (0.36) PARP1LMNAUSP2SPRPOLB
SCHEMBL17896049 0.75 LMNA (0.35) LMNAUSP2SPRPOLBMAPT
SCHEMBL17895779 0.74 LMNA (0.34) LMNAUSP2SPRMAPTTDP1
SCHEMBL17895839 0.74 PLK1 (0.47) PARP1LMNAUSP2SPRMAPT
SCHEMBL17895985 0.74 DRD2 (0.43) PARP1LMNAUSP2SPRMAPT
SCHEMBL17896079 0.74 LMNA (0.35) LMNAUSP2POLBMAPTTDP1
SCHEMBL17896153 0.74 LMNA (0.37) LMNAUSP2SPRPOLBMAPT
SCHEMBL17895899 0.74 LMNA (0.33) LMNAUSP2SPRMAPTPKM

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 3 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
WO-2016109706-A1 FUSED POLYCYCLIC 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS PTC THERAPEUTICS, INC. (US) 2016-07-07 — — WO disclosed
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