SCHEMBL18079702

SCHEMBL18079702

Clc1ccccc1CSc1ccc(-c2ccccn2)nn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.71
RAB9A P51151 8/20 0.67
NPC1 O15118 6/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
HTT P42858 6/20 0.67
KMT2A Q03164 3/20 0.67
LMNA P02545 3/20 0.67
MEN1 O00255 2/20 0.67
GAA P10253 2/20 0.67
KDM4E B2RXH2 6/20 0.66
MAPT P10636 3/20 0.66
NFKB1 P19838 1/20 0.66
NFKB2 Q00653 1/20 0.66
RELA Q04206 1/20 0.66
ALDH1A1 P00352 4/20 0.50
TP53 P04637 1/20 0.50
PKM P14618 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 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
SCHEMBL18080851 0.91 SLC1A2 (0.67) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18079716 0.87 RAB9A (0.69) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18079719 0.86 RAB9A (0.57) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18079709 0.86 RAB9A (0.67) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18080854 0.85 RAB9A (0.59) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18079710 0.85 SLC1A2 (0.66) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL14685055 0.83 SLC1A2 (1.00) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL30674412 0.83 SLC1A2 (1.00) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL18079713 0.83 SLC1A2 (0.79) SLC1A2RAB9ANPC1SMN1; SMN2HTT
SCHEMBL14685052 0.81 SMN1; SMN2 (0.65) SLC1A2RAB9ANPC1SMN1; SMN2HTT

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