SCHEMBL16429528

SCHEMBL16429528

CC1=CCCC(Nc2ncccc2Sc2cccc(O)c2)=N1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GCK P35557 1/20 0.33
PIK3CD O00329 3/20 0.32
PIK3CA P42336 3/20 0.32
PIK3CG P48736 3/20 0.32
PIK3CB P42338 2/20 0.32
MTOR P42345 2/20 0.32
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
CASP3 P42574 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
SENP8 Q96LD8 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SENP7 Q9BQF6 1/20 0.31

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
SCHEMBL1330623 0.73 GCK (0.61) SMN1; SMN2GCKMEN1NPC1USP2
SCHEMBL1329480 0.61 GCK (0.51) GRM5SMN1; SMN2GCKMEN1NPC1
Hydrochloric Acid SCHEMBL1330742 0.61 GCK (0.50) GRM5SMN1; SMN2GCKMEN1NPC1
SCHEMBL6136798 0.60 ALDH1A1 (0.46) SMN1; SMN2PIK3CDMEN1ALDH1A1POLB
SCHEMBL2239504 0.58 CA12 (0.58) SMN1; SMN2ALDH1A1HSD17B10RETKIF5B
SCHEMBL31281467 0.58 CA12 (0.58) SMN1; SMN2ALDH1A1HSD17B10RETKIF5B
SCHEMBL7938044 0.58 SMN1; SMN2 (0.47) SMN1; SMN2PIK3CAMTORNPC1ALDH1A1
SCHEMBL1328903 0.58 GCK (0.62) SMN1; SMN2GCKMEN1NPC1ALDH1A1
SCHEMBL1329648 0.57 GCK (0.60) GCKMEN1NPC1GAARAB9A
SCHEMBL1328821 0.56 GCK (0.56) GCKMEN1NPC1GAARAB9A

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-2543667-B1 A method of preparing 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC (US) 2015-01-28 EP disclosed