SCHEMBL7683302

SCHEMBL7683302

O=S(=O)(Nc1ccc(Cl)cc1)c1cc(Cl)c2cccnc2c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
SLC40A1 Q9NP59 4/20 0.53
ALDH1A1 P00352 4/20 0.52
MMP14 P50281 3/20 0.52
KDM4E B2RXH2 3/20 0.52
HSP90AA1 P07900 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
LMNA P02545 2/20 0.52
TP53 P04637 2/20 0.52
CYP3A4 P08684 2/20 0.52
MAPT P10636 2/20 0.52
ALOX15 P16050 2/20 0.52
ALOX12 P18054 2/20 0.52
SLC6A2 P23975 2/20 0.52
OPRK1 P41145 2/20 0.52
HTT P42858 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
ALOX15B O15296 1/20 0.52
NR1I2 O75469 1/20 0.52

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
SCHEMBL7688576 0.85 KMT2A (0.55) MEN1KMT2ASLC40A1ALDH1A1SMN1; SMN2
SCHEMBL7685023 0.82 ALDH1A1 (0.61) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL7691072 0.81 KMT2A (0.62) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL7686368 0.81 MAPT (0.55) MEN1KMT2AMAPTMCL1
SCHEMBL10908982 0.79 MEN1 (0.64) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL7787448 0.76 KDM4E (0.64) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL7694852 0.74 HTT (0.54) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL14043198 0.73 SLC40A1 (0.60) MEN1KMT2ASLC40A1KDM4EHSP90AA1
Bromide SCHEMBL7687716 0.72 ALDH1A1 (0.50) MEN1KMT2AALDH1A1MMP14KDM4E
SCHEMBL22802119 0.71 COMT (0.67) MEN1KMT2AALDH1A1MMP14KDM4E

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