SCHEMBL7690128

SCHEMBL7690128

Cc1ccc2c(Cl)cc(S(=O)(=O)NCc3cccc(Cl)c3)c(O)c2n1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.52
CNR1 P21554 1/20 0.48
MAPT P10636 1/20 0.48
TP53 P04637 1/20 0.45
CD38 P28907 1/20 0.44
GPR17 Q13304 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
HCRTR1 O43613 1/20 0.41
CYP19A1 P11511 2/20 0.41
ACLY P53396 2/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
NAMPT P43490 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SLC12A2 P55011 1/20 0.39
SLC12A5 Q9H2X9 1/20 0.39

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
SCHEMBL7689285 0.90 MAPT (0.51) MCL1MAPTACLYGAAKDM4E
SCHEMBL7691447 0.88 MAPT (0.51) MCL1CNR1MAPTCD38KMT2A
SCHEMBL7692330 0.83 MAPT (0.48) MCL1MAPTCD38ACLY
SCHEMBL8311550 0.82 MAPT (0.49) MAPTACLYGAAHTT
SCHEMBL7686834 0.81 ALDH1A1 (0.52) MAPTTP53KMT2AMEN1ACLY
SCHEMBL7691523 0.80 SMN1; SMN2 (0.55) TP53KMT2AMEN1GAAKDM4E
SCHEMBL7691423 0.80 TDP1 (0.50) MAPTTP53KMT2AMEN1ACLY
SCHEMBL7690995 0.80 MAPT (0.49) MAPTTP53KMT2AMEN1ACLY
SCHEMBL7691430 0.78 KMT2A (0.50) MAPTTP53KMT2AMEN1ACLY
SCHEMBL7689574 0.78 MAPT (0.47) CNR1MAPTTP53CD38KMT2A

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-6211376-B1 HERPES VIRUS, CYTOMEGALO VIRUS, VARICELLA-ZOSTER VIRUS,EPSTEIN-BARR VIRUS PHARMACIA & UPJOHN COMPANY 2001-04-03 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