SCHEMBL7047826

SCHEMBL7047826

Cc1ccc(-c2nc(-c3ncccc3C)no2)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.50
RAB9A P51151 9/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
TP53 P04637 5/20 0.50
MAPT P10636 4/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.46
PKM P14618 3/20 0.46
GAA P10253 2/20 0.46
MITF O75030 1/20 0.46
HPGD P15428 3/20 0.44
NPSR1 Q6W5P4 3/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.44
GLA P06280 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP3 P42574 2/20 0.43

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
SCHEMBL6453543 0.91 NPC1 (0.46) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6450555 0.87 NPC1 (0.50) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6452535 0.86 CASP3 (0.60) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6454139 0.85 NPC1 (0.47) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL7049265 0.85 NPC1 (0.51) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6448952 0.83 TP53 (0.50) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6452697 0.83 NPC1 (0.45) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6449934 0.81 ACACB (0.42) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6449987 0.81 MAPT (0.46) NPC1RAB9ASMN1; SMN2TP53MAPT
SCHEMBL6448673 0.81 NPC1 (0.51) NPC1RAB9ASMN1; SMN2TP53MAPT

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
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 WO disclosed