SCHEMBL16502201

SCHEMBL16502201

Cc1ccc(NN=N)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.38
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
ADRA2A P08913 2/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
SORT1 Q99523 1/20 0.35
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
GRM5 P41594 2/20 0.33
MAOB P27338 1/20 0.33
MAPK10 P53779 1/20 0.32
HPGDS O60760 1/20 0.32

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
SCHEMBL21241333 0.76 NPSR1 (0.40) NPSR1KCNQ3KCNQ2ADRA2AADRA2B
SCHEMBL22137313 0.75 NPSR1 (0.43) NPSR1KCNQ3KCNQ2ADRA2AADRA2B
SCHEMBL14234945 0.75 NPSR1 (0.43) NPSR1KCNQ3KCNQ2ADRA2AADRA2B
SCHEMBL13025235 0.73 ADRA2A (0.44) NPSR1KCNQ3KCNQ2ADRA2AADRA2B
SCHEMBL30937277 0.73
SCHEMBL1746357 0.73
SCHEMBL15426953 0.71
SCHEMBL31335160 0.71
SCHEMBL368556 0.71
SCHEMBL16127546 0.71

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
EP-2207781-B1 THIAZOLOPYRIMIDINE P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2012-11-28 EP disclosed