SCHEMBL17895899

SCHEMBL17895899

Cc1nc2c(n1CCN)CCCc1c-2[nH]c(=O)c(C(=O)O)c1O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TSHR P16473 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ PKM P14618 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SPR P35270 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
Trifluoroacetic Acid SCHEMBL17895971 0.94 LMNA (0.30) LMNAMAPT
SCHEMBL17895779 0.91 LMNA (0.34) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17896078 0.89 HTT (0.34) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17896153 0.89 LMNA (0.37) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17895905 0.88 LMNA (0.34) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17896285 0.88 CRHBP (0.38) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17896001 0.87 ALDH1A1 (0.37) LMNAMAPTTSHRKDM4EALDH1A1
Hydrochloric Acid SCHEMBL17895974 0.86 ALDH1A1 (0.37) LMNAMAPTTSHRKDM4EALDH1A1
SCHEMBL17895829 0.86 MAPT (0.34) LMNAMAPTTSHRKDM4EMEN1
SCHEMBL17895978 0.85 LMNA (0.34) LMNAMAPTTSHRKDM4EMEN1

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
Send feedback