SCHEMBL17896034

SCHEMBL17896034

CCn1c(COC(C)=O)nc2c1CCCc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ TSHR P16473 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ PKM P14618 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
SCHEMBL17896017 0.90 LMNA (0.34) LMNAALDH1A1TSHRKDM4EUSP2
SCHEMBL17896121 0.88 LMNA (0.34) LMNAALDH1A1TSHRKDM4EUSP2
SCHEMBL17895780 0.87 LMNA (0.34) LMNAALDH1A1TSHRKDM4EUSP2
SCHEMBL17896074 0.87 LMNA (0.32) LMNAALDH1A1TSHRKDM4E
SCHEMBL17895830 0.86 LMNA (0.32) LMNAALDH1A1TSHRKDM4EUSP2
SCHEMBL17895925 0.85 LMNA (0.33) LMNAALDH1A1TSHRKDM4EUSP2
SCHEMBL17896133 0.85 ALDH1A1 (0.36) LMNAALDH1A1TSHRKDM4E
SCHEMBL17895982 0.85 LMNA (0.31) LMNAALDH1A1TSHRKDM4E
SCHEMBL17896071 0.85 ALDH1A1 (0.34) LMNAALDH1A1TSHRKDM4EPKM
SCHEMBL17896063 0.85 TSHR (0.35) LMNAALDH1A1TSHRKDM4EUSP2

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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