SCHEMBL7815643

SCHEMBL7815643

CCN(CCC=S(=O)=O)c1ccc2nc3c4cc(O)ccc4c(=O)cc-3oc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
POLB P06746 2/20 0.60
NPC1 O15118 1/20 0.60
RAB9A P51151 1/20 0.60
SCP2 P22307 1/20 0.54
GPR84 Q9NQS5 10/20 0.40
ALDH1A1 P00352 5/20 0.39
MAPT P10636 3/20 0.39
IGLV6-57 P01721 2/20 0.37
QPCT Q16769 1/20 0.37
GLA P06280 5/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
CYP3A4 P08684 3/20 0.35
HPGD P15428 3/20 0.35
ATM Q13315 2/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL56792 0.88 MEN1 (0.76) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL4664437 0.84 MEN1 (0.76) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL7805770 0.81 SCP2 (0.65) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL18072729 0.79 SCP2 (0.62) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL18072706 0.78 SCP2 (0.56) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL23733292 0.77 MEN1 (0.58) MEN1KMT2APOLBNPC1RAB9A
Nile Red SCHEMBL28703996 0.77 MEN1 (0.93) MEN1KMT2APOLBNPC1RAB9A
Nile Red SCHEMBL29373685 0.76 MEN1 (1.00) MEN1KMT2APOLBNPC1RAB9A
Nile Red SCHEMBL49047 0.76 MEN1 (1.00) MEN1KMT2APOLBNPC1RAB9A
SCHEMBL16696324 0.75 MEN1 (0.61) MEN1KMT2APOLBNPC1RAB9A

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
EP-0885263-B1 BENZOPHENOXAZINE DYES AMERSHAM PHARM BIOTECH UK LTD (GB) 2001-04-25 EP disclosed
US-6166202-A Benzophenoxazine dyes AMERSHAM PHARMACIA BIOTECH UK LIMITED (GB) 2000-12-26 US disclosed
EP-0885263-A1 BENZOPHENOXAZINE DYES Amersham Pharmacia Biotech UK Limited (GB) 1998-12-23 EP disclosed
WO-1997029154-A1 BENZOPHENOXAZINE DYES AMERSHAM PHARMACIA BIOTECH UK LIMITED (GB) 1997-08-14 WO disclosed