SCHEMBL7687801

SCHEMBL7687801

O=C(c1ccc2cccnc2c1O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.66
EGLN1 Q9GZT9 15/20 0.59
LMNA P02545 2/20 0.47
ALOX12 P18054 1/20 0.47
MMP2 P08253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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 SCHEMBL7692786 0.99 ALDH1A1 (0.64) ALDH1A1EGLN1LMNAALOX12MMP2
SCHEMBL2143852 0.86 ALDH1A1 (0.62) ALDH1A1EGLN1LMNAALOX12L3MBTL1
SCHEMBL2143835 0.83 ALDH1A1 (0.58) ALDH1A1EGLN1
SCHEMBL27872555 0.81 ALDH1A1 (0.77) ALDH1A1EGLN1LMNAMMP2
SCHEMBL2143889 0.81 ALDH1A1 (0.56) ALDH1A1EGLN1L3MBTL1
SCHEMBL6487277 0.81 ALDH1A1 (0.71) ALDH1A1EGLN1LMNAALOX12
SCHEMBL31023212 0.81 ALDH1A1 (0.71) ALDH1A1EGLN1LMNAALOX12
SCHEMBL1759043 0.80 ALDH1A1 (1.00) ALDH1A1EGLN1LMNAALOX12L3MBTL1
SCHEMBL9139640 0.79 ALDH1A1 (0.97) ALDH1A1EGLN1LMNAALOX12L3MBTL1
SCHEMBL2143783 0.78 EGLN1 (0.60) ALDH1A1EGLN1LMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6500842-B1 N-((4-CHLOROPHENYL)METHYL)-8-HYDROXY-7-QUINOLINECARBOXAMIDE ADMINISTERED AS VIRICIDES AGAINST HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-12-31 US claimed
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-6500842-B1 N-((4-CHLOROPHENYL)METHYL)-8-HYDROXY-7-QUINOLINECARBOXAMIDE ADMINISTERED AS VIRICIDES AGAINST HERPES VIRUS PHARMACIA & UPJOHN COMPANY 2002-12-31 US disclosed
US-6310211-B1 ANTI-VIRAL ACTIVITY AGAINST HERPES VIRUS, CYTOMEGALOVIRUS. MANY OF THESE COMPOUNDS ARE ALSO ACTIVE AGAINST VARICELLA ZOSTER VIRUS, EPSTEIN-BARR VIRUS, HERPES SIMPLEX VIRUS AND HUMAN HERPES VIRUS TYPE 8 PHARMACIA & UPJOHN COMPANY 2001-10-30 US disclosed
US-6252080-B1 HERPES, CYTOMEGALO VIRUS PHARMACIA & UPJOHN COMPANY 2001-06-26 US disclosed
US-6211376-B1 HERPES VIRUS, CYTOMEGALO VIRUS, VARICELLA-ZOSTER VIRUS,EPSTEIN-BARR VIRUS PHARMACIA & UPJOHN COMPANY 2001-04-03 US disclosed
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