SCHEMBL17896007

SCHEMBL17896007

CCc1nc2n(c1CC)CCCc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.37
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ APEX1 P27695 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ HIF1A Q16665 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
Hydrochloric Acid SCHEMBL17896090 0.99 LMNA (0.36) LMNAKDM4EALDH1A1TSHRMAPT
SCHEMBL17895831 0.88 LMNA (0.36) LMNAKDM4EALDH1A1TSHRMAPT
Hydrochloric Acid SCHEMBL17895824 0.88 LMNA (0.35) LMNAKDM4EALDH1A1TSHRMAPT
SCHEMBL17896059 0.81 ALDH1A1 (0.36) LMNAKDM4EALDH1A1TSHRPKM
Hydrochloric Acid SCHEMBL17895933 0.80 ALDH1A1 (0.35) LMNAKDM4EALDH1A1TSHRPKM
SCHEMBL17895960 0.79 LMNA (0.37) LMNAKDM4EALDH1A1TSHRMAPT
SCHEMBL17895916 0.78 LMNA (0.32) LMNAKDM4EALDH1A1TSHRPOLB
Hydrochloric Acid SCHEMBL17896058 0.77 LMNA (0.32) LMNAALDH1A1POLBUSP2APEX1
SCHEMBL17896053 0.75 LMNA (0.35) LMNAKDM4EALDH1A1TSHRMAPT
SCHEMBL17896150 0.74 LMNA (0.30) LMNA

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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