SCHEMBL2824920

SCHEMBL2824920

Cc1nc(OC(=O)Nc2cccc(Cl)c2)c(Nc2cnccc2C)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
MAPT P10636 5/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 4/20 0.41
HTT P42858 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
HPGD P15428 2/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
ALOX15 P16050 1/20 0.40
TP53 P04637 2/20 0.40
XBP1 P17861 1/20 0.39
POLB P06746 2/20 0.39
GRM5 P41594 1/20 0.39

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
SCHEMBL2828233 0.88 SMARCA2 (0.42) ABL1BCRNPC1RAB9AGRM5
SCHEMBL2826781 0.87 GRM5 (0.52) ABL1BCRMAPTMEN1KMT2A
SCHEMBL2832150 0.87 KMT2A (0.50) MAPTGAAMEN1KMT2ALMNA
SCHEMBL2830413 0.85 GRM5 (0.51) ABL1BCRMAPTGRM5
SCHEMBL2828398 0.84 GRM5 (0.47) MAPTGAAMEN1KMT2ALMNA
SCHEMBL2826581 0.82 GRM5 (0.50) MAPTKMT2ANPC1RAB9AGRM5
SCHEMBL2827550 0.81 BRAF (0.48) MAPTGAAMEN1KMT2ALMNA
SCHEMBL2825999 0.79 LMNA (0.41) MAPTGAAMEN1KMT2ALMNA
SCHEMBL2830402 0.79 MAPT (0.45) MAPTGAAMEN1KMT2ALMNA
SCHEMBL2830277 0.78 MAPT (0.42) MAPTGAAMEN1KMT2ALMNA

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-1844044-B1 THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2010-07-21 EP claimed