SCHEMBL17895830

SCHEMBL17895830

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

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ USP2 O75604 1/20 0.31
▸ PKM P14618 1/20 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
SCHEMBL17896074 0.92 LMNA (0.32) LMNATSHRKDM4EALDH1A1
SCHEMBL17896017 0.92 LMNA (0.34) LMNATSHRKDM4EALDH1A1USP2
SCHEMBL17896034 0.86 LMNA (0.35) LMNATSHRKDM4EALDH1A1USP2
SCHEMBL17896133 0.86 ALDH1A1 (0.36) LMNATSHRKDM4EALDH1A1
SCHEMBL17896121 0.86 LMNA (0.34) LMNATSHRKDM4EALDH1A1USP2
SCHEMBL17895780 0.85 LMNA (0.34) LMNATSHRKDM4EALDH1A1USP2
Hydrochloric Acid SCHEMBL17896125 0.84 ALDH1A1 (0.31) KDM4EALDH1A1
SCHEMBL17901957 0.83 — —
SCHEMBL17895925 0.83 LMNA (0.33) LMNATSHRKDM4EALDH1A1USP2
SCHEMBL17895982 0.82 LMNA (0.31) LMNATSHRKDM4EALDH1A1

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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