SCHEMBL8309972

SCHEMBL8309972

O=C(NCCc1cccc2ccccc12)c1ccc2cccnc2c1O

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 14/20 0.71
MEN1 O00255 1/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
KMT2A Q03164 1/20 0.61
MTNR1A P48039 2/20 0.52
ALDH1A1 P00352 1/20 0.51
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 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
SCHEMBL7694885 0.88 EGLN1 (0.73) EGLN1ALDH1A1ADORA2AADORA1
SCHEMBL7956952 0.86 MEN1 (0.79) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL7951114 0.86 EGLN1 (0.71) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL5228962 0.84 PTGS2 (0.65) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL8310038 0.83 EGLN1 (1.00) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL7690012 0.81 EGLN1 (0.67) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL7690447 0.80 EGLN1 (0.84) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL7683265 0.79 EGLN1 (0.72) EGLN1MEN1NPC1RAB9AKMT2A
SCHEMBL2292957 0.79 EGLN1 (0.86) EGLN1NPC1RAB9AALDH1A1
SCHEMBL7898025 0.78 MTNR1A (0.68) MEN1NPC1RAB9AKMT2AMTNR1A

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 4 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
EP-0927164-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1999-07-07 EP disclosed
WO-1998011073-A1 8-HYDROXY-7-SUBSTITUTED QUINOLINES AS ANTI-VIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 1998-03-19 WO disclosed