SCHEMBL30828396

SCHEMBL30828396

CN(N)c1cccc(Br)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.41
HTR1A P08908 1/20 0.41
DRD2 P14416 1/20 0.41
HTR2A P28223 1/20 0.41
CLK1 P49759 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 2/20 0.33
ALOX5 P09917 2/20 0.31
GRM5 P41594 1/20 0.30

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
SCHEMBL132925 1.00 HTR7 (0.41) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL21594682 0.82 HTR7 (0.43) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL31579202 0.82 HTR7 (0.43) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL29835540 0.82 NCF1 (0.43) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL906769 0.82 NCF1 (0.43) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL19752022 0.78 HTR7 (0.41) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL18884378 0.76 NOS3 (0.48) MEN1KMT2AGAAGRM5
SCHEMBL24102171 0.75 TAAR1 (0.41) HTR7HTR2AALOX5
SCHEMBL6632726 0.75 HTR7 (0.42) HTR7HTR1ADRD2HTR2ACLK1
SCHEMBL1110998 0.75 HTR7 (0.42) HTR7HTR1ADRD2HTR2ACLK1

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
CN-112313230-B Novel compounds for the treatment, alleviation or prevention of conditions associated with Tau aggregate AC免疫有限公司 2024-03-15 CN disclosed