SCHEMBL8036067

SCHEMBL8036067

Oc1ccc(-c2nc(-c3ccc(Br)cc3)nc(-c3ccc(O)cc3O)n2)c(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
CNR1 P21554 1/20 0.52
CNR2 P34972 1/20 0.52
GPR55 Q9Y2T6 1/20 0.52
MIF P14174 1/20 0.42
NPC1 O15118 4/20 0.41
ALOX15 P16050 3/20 0.41
RAB9A P51151 3/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
GAA P10253 2/20 0.41
HSP90AA1 P07900 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALOX5 P09917 1/20 0.41
MAPT P10636 2/20 0.41
NTSR1 P30989 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL6444289 0.89 MEN1 (0.50) MEN1KMT2ANPC1ALOX15RAB9A
SCHEMBL4981440 0.89 MEN1 (0.50) MEN1KMT2ANPC1ALOX15RAB9A
SCHEMBL29625130 0.82 NPC1 (0.52) NPC1RAB9AALDH1A1GAAHSP90AA1
SCHEMBL547889 0.82 NPC1 (0.52) NPC1RAB9AALDH1A1GAAHSP90AA1
SCHEMBL29740228 0.82 ALOX5 (0.60) MEN1KMT2ACNR1CNR2GPR55
SCHEMBL1243182 0.82 MEN1 (0.53) MEN1KMT2AGPR55MIFNPC1
SCHEMBL14070528 0.82 MEN1 (0.47) MEN1KMT2ACNR1CNR2GPR55
SCHEMBL1245329 0.82 MEN1 (0.47) MEN1KMT2ACNR1CNR2GPR55
SCHEMBL580776 0.82 MEN1 (0.53) MEN1KMT2AGPR55MIFNPC1
SCHEMBL29381883 0.82 MEN1 (0.53) MEN1KMT2AGPR55MIFNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0982356-A2 Improved stabilized coatings Clariant Finance (BVI) Limited (VG) 2000-03-01 EP disclosed