SCHEMBL7956952

SCHEMBL7956952

O=C(NCCc1ccccc1F)c1ccc2cccnc2c1O

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.79
NPC1 O15118 1/20 0.79
RAB9A P51151 1/20 0.79
KMT2A Q03164 1/20 0.79
EGLN1 Q9GZT9 14/20 0.71
ALDH1A1 P00352 2/20 0.51
LMNA P02545 1/20 0.49
HIF1A Q16665 2/20 0.48

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
SCHEMBL7951114 0.86 EGLN1 (0.71) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL8309972 0.86 EGLN1 (0.71) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL8310038 0.83 EGLN1 (1.00) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL7957180 0.82 EGLN1 (0.80) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL7690012 0.81 EGLN1 (0.67) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL7690447 0.80 EGLN1 (0.84) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL7691139 0.80 EGLN1 (0.67) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL5228962 0.79 PTGS2 (0.65) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL7683265 0.79 EGLN1 (0.72) MEN1NPC1RAB9AKMT2AEGLN1
SCHEMBL2292957 0.79 EGLN1 (0.86) NPC1RAB9AEGLN1ALDH1A1

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
EP-0927164-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-07 EP claimed
WO-1998011073-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1998-03-19 WO claimed
US-6211376-B1 HERPES VIRUS, CYTOMEGALO VIRUS, VARICELLA-ZOSTER VIRUS,EPSTEIN-BARR VIRUS PHARMACIA & UPJOHN COMPANY 2001-04-03 US disclosed