SCHEMBL6869500

SCHEMBL6869500

O=Nc1ccc(O)c2nc(Cl)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
TDP1 Q9NUW8 3/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
KDM4E B2RXH2 2/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
ALDH1A1 P00352 2/20 0.54
XBP1 P17861 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
KMT2A Q03164 5/20 0.36
OPRK1 P41145 2/20 0.36
CTSB P07858 2/20 0.33
CTSH P09668 1/20 0.33
PIM1 P11309 1/20 0.33
GLO1 Q04760 3/20 0.33
ERN1 O75460 1/20 0.32
LMNA P02545 3/20 0.32
BRD4 O60885 2/20 0.32
HSP90AA1 P07900 1/20 0.32
METAP2 P50579 1/20 0.32

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
SCHEMBL9876928 0.82 MAPT (0.57) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL28191903 0.79 ALDH1A1 (0.36) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL3984759 0.76 MAPT (0.53) MAPTTDP1KDM4EALDH1A1KMT2A
SCHEMBL6869752 0.73 IDO1 (0.50) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL12834067 0.72 KDM4E (0.40) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL105461 0.70 L3MBTL1 (1.00) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL29624594 0.70 L3MBTL1 (1.00) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL10705051 0.70 CTSB (0.68) MAPTTDP1L3MBTL1KDM4ENPC1
SCHEMBL31157828 0.69 L3MBTL1 (0.97) MAPTTDP1L3MBTL1KDM4ENPC1
Hydrochloric Acid SCHEMBL6865586 0.69 L3MBTL1 (0.97) MAPTTDP1L3MBTL1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818653-B1 7-THIOCYANO SUBSTITUENT; REACTING 6,7-DIHALO-5,8-QUINOLINEDIONE AND ANILINE DERIVATIVE; AMINATION IL JIN COPPER FOIL CORP. (KR) 2004-11-16 US disclosed
EP-1175403-A4 6,7-DISUBSTITUTED-5,8-QUINOLINEDIONE DERIVATIVES AS AN ANTIFUNGAL AGENT IL JIN COPPER FOIL CORP (KR) 2002-06-12 EP disclosed
EP-1175403-A1 6,7-DISUBSTITUTED-5,8-QUINOLINEDIONE DERIVATIVES AS AN ANTIFUNGAL AGENT Il Jin Copper Foil Corp. (KR) 2002-01-30 EP disclosed
WO-2001012605-A1 6,7-DISUBSTITUTED-5,8-QUINOLINEDIONE DERIVATIVES AS AN ANTIFUNGAL AGENT IL JIN COPPER FOIL CORP. (KR) 2001-02-22 WO disclosed