SCHEMBL6027348

SCHEMBL6027348

Clc1ccsc1COc1cccc2cccnc12

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.58
RAB9A P51151 7/20 0.55
NPC1 O15118 7/20 0.55
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
ALDH1A1 P00352 5/20 0.50
NPSR1 Q6W5P4 2/20 0.50
GAA P10253 2/20 0.50
POLB P06746 1/20 0.50
HPGD P15428 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
TP53 P04637 2/20 0.48
MAPT P10636 6/20 0.47
LMNA P02545 5/20 0.46
HTT P42858 1/20 0.46
MAPK1 P28482 1/20 0.46
HDAC6 Q9UBN7 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
SCHEMBL645561 0.81 RAB9A (0.66) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6217892 0.77 KDM4E (0.56) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6021515 0.75 RAB9A (0.67) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6223828 0.75 KDM4E (0.62) KDM4ERAB9ANPC1MEN1KMT2A
Hydrochloric Acid SCHEMBL9050534 0.74 KDM4E (0.60) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6027050 0.74 NPC1 (0.75) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL4438607 0.73 NPC1 (0.66) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6026024 0.73 KDM4E (0.71) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6026902 0.72 NPC1 (0.64) KDM4ERAB9ANPC1MEN1KMT2A
SCHEMBL6026966 0.72 RAB9A (0.59) KDM4ERAB9ANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1075483-B1 HYGROMYCIN A DERIVATIVES PFIZER PROD INC (US) 2003-12-03 EP claimed
EP-1077984-B1 2\"-DEOXY HYGROMYCIN DERIVATIVES PFIZER PROD INC (US) 2003-06-18 EP claimed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 US claimed
US-6313100-B1 ANTIBACTERIAL, ANTIPROTOZOA AGENTS PFIZER INC 2001-11-06 US claimed
EP-1369490-B1 Method of preparing a composition containing hygromycin A and epi-hygromycin PFIZER PROD INC (US) 2006-02-08 EP disclosed
EP-1369490-A1 Method of preparing a composition containing hygromycin A and epi-hygromycin Pfizer Products Inc. (US) 2003-12-10 EP disclosed
EP-1075483-B1 HYGROMYCIN A DERIVATIVES PFIZER PROD INC (US) 2003-12-03 EP disclosed
EP-1077984-B1 2\"-DEOXY HYGROMYCIN DERIVATIVES PFIZER PROD INC (US) 2003-06-18 EP disclosed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 US disclosed
US-6313100-B1 ANTIBACTERIAL, ANTIPROTOZOA AGENTS PFIZER INC 2001-11-06 US disclosed