SCHEMBL18079709

SCHEMBL18079709

Clc1cccc(Cl)c1CSc1ccc(-c2ccccn2)nn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.67
SMN1; SMN2 Q16637 8/20 0.67
NPC1 O15118 7/20 0.67
HTT P42858 6/20 0.67
MEN1 O00255 3/20 0.67
KMT2A Q03164 3/20 0.67
LMNA P02545 3/20 0.67
GAA P10253 2/20 0.67
KDM4E B2RXH2 7/20 0.66
MAPT P10636 4/20 0.66
NFKB1 P19838 1/20 0.66
NFKB2 Q00653 1/20 0.66
RELA Q04206 1/20 0.66
SLC1A2 P43004 1/20 0.60
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 4/20 0.50
POLB P06746 2/20 0.50
BLM P54132 1/20 0.50
TP53 P04637 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL14685052 0.91 SMN1; SMN2 (0.65) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18079702 0.86 SLC1A2 (0.71) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18080851 0.85 SLC1A2 (0.67) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18079701 0.83 SLC1A2 (0.76) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL16155555 0.83 RAB9A (0.66) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18079711 0.81 SMN1; SMN2 (0.52) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18080850 0.80 RAB9A (0.74) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18079703 0.80 RAB9A (1.00) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18079716 0.79 RAB9A (0.69) RAB9ASMN1; SMN2NPC1HTTMEN1
SCHEMBL18080856 0.78 RAB9A (0.63) RAB9ASMN1; SMN2NPC1HTTMEN1

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-9447075-B2 Pyridazine derivatives as EAAT2 activators THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2016-09-20 US disclosed
US-9447075-B2 Pyridazine derivatives as EAAT2 activators THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2016-09-20 US disclosed