SCHEMBL13533794

SCHEMBL13533794

Cc1nc2cc3nc(-c4ccc(C)c(C)c4)[nH]c3cc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
POLB P06746 3/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
NPBWR1 P48145 2/20 0.59
KDM4E B2RXH2 4/20 0.58
MAPT P10636 4/20 0.58
ALDH1A1 P00352 3/20 0.58
GLA P06280 1/20 0.58
GAA P10253 1/20 0.58
GFER P55789 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
HPSE Q9Y251 1/20 0.48
PKM P14618 2/20 0.48
HPGD P15428 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48

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
SCHEMBL13533840 0.89 NPC1 (0.71) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL12347958 0.87 NPC1 (0.68) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL13286776 0.84 NPC1 (0.59) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL13533861 0.83 NPC1 (0.57) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL13533788 0.81 NPBWR1 (0.49) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL14193952 0.81 NPC1 (0.63) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL24515247 0.80 NPC1 (0.62) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL13533829 0.80 NPBWR1 (0.58) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL21976216 0.79 ALOX5 (0.65) NPC1RAB9APOLBSMN1; SMN2MEN1
SCHEMBL13533785 0.79 NPC1 (0.62) NPC1RAB9APOLBSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649025-B2 Composite ion-exchange membrane TOYO BOSEKI KABUSHIKI KAISHA (JP) 2010-01-19 US disclosed
US-7537852-B2 Composite ion exchange membrane and electrolyte membrane electrode assembly TOYO BOSEKI KABUSHIKI KAISHA (JP) 2009-05-26 US disclosed