SCHEMBL17895823

SCHEMBL17895823

Cc1cc2c(n1C)CCCc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.35
▸ USP2 O75604 1/20 0.34
▸ BRD4 O60885 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ LDHA P00338 1/20 0.31
▸ LDHB P07195 1/20 0.31
▸ SPR P35270 1/20 0.31
▸ KDM4E B2RXH2 4/20 0.31
▸ MAPT P10636 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ POLB P06746 3/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ HTT P42858 2/20 0.31

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
SCHEMBL17895947 0.85 TSHR (0.42) LMNAUSP2GAAPKMKDM4E
SCHEMBL17896002 0.85 LMNA (0.38) LMNAUSP2GAAPKMKDM4E
SCHEMBL17895906 0.84 NOTUM (0.38) LMNAUSP2BRD4GAASPR
SCHEMBL17895839 0.80 PLK1 (0.47) LMNAUSP2PKMSPRKDM4E
SCHEMBL17896049 0.79 LMNA (0.35) LMNAUSP2PKMLDHALDHB
SCHEMBL17896080 0.78 LMNA (0.41) LMNAUSP2GAAPKMSPR
SCHEMBL17895978 0.78 LMNA (0.34) LMNAUSP2GAAPKMSPR
SCHEMBL17895874 0.77 LMNA (0.37) LMNAUSP2PKMLDHALDHB
SCHEMBL17896114 0.75 HSD11B1 (0.36) LMNAUSP2PKMSPRKDM4E
SCHEMBL17895886 0.75 ELANE (0.34) LMNAUSP2SPRMAPTNPC1

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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