SCHEMBL7956987

SCHEMBL7956987

O=C(N[C@H]1CC[C@H](O)CC1)c1ccc2cccnc2c1O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 18/20 0.56
ALDH1A1 P00352 1/20 0.55
PBK Q96KB5 1/20 0.46

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
SCHEMBL7956990 1.00 EGLN1 (0.56) EGLN1ALDH1A1PBK
SCHEMBL7691769 0.89 EGLN1 (0.56) EGLN1ALDH1A1
SCHEMBL7685902 0.89 EGLN1 (0.57) EGLN1ALDH1A1
SCHEMBL7692327 0.89 EGLN1 (0.57) EGLN1ALDH1A1
SCHEMBL2201061 0.86 EGLN1 (0.55) EGLN1ALDH1A1
SCHEMBL7691046 0.86 EGLN1 (0.53) EGLN1ALDH1A1
SCHEMBL8310762 0.85 EGLN1 (0.51) EGLN1ALDH1A1
SCHEMBL8310763 0.85 EGLN1 (0.51) EGLN1ALDH1A1
SCHEMBL2204759 0.81 ALDH1A1 (0.53) EGLN1ALDH1A1
SCHEMBL2204755 0.81 EGLN1 (0.52) EGLN1ALDH1A1

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