SCHEMBL13504167

SCHEMBL13504167

CC(C)C(=O)c1cc(C(=O)Nc2n[c]c(Cl)s2)n(Cc2ccc(F)c(F)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
CACNA1H O95180 6/20 0.35
CACNA1G O43497 5/20 0.35
CACNA1I Q9P0X4 5/20 0.35
P2RY14 Q15391 1/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TP53 P04637 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
GRM4 Q14833 1/20 0.33
PDPK1 O15530 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
POLB P06746 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 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
SCHEMBL2661791 0.81 GCK (0.42) MAPTCACNA1HCACNA1GCACNA1IP2RY14
SCHEMBL2662463 0.81 MEN1 (0.48) MEN1KMT2ATP53NPC1GAA
SCHEMBL3746609 0.78 MAPT (0.34) MAPTCACNA1HCACNA1GCACNA1IP2RY14
SCHEMBL13504193 0.77 SCN3A (0.38) MEN1KMT2AGRM4PDPK1ALDH1A1
SCHEMBL2660065 0.75 P2RY14 (0.40) MAPTCACNA1HCACNA1GCACNA1IP2RY14
SCHEMBL2660375 0.75 MAPK10 (0.39) MAPTCACNA1HTP53ALDH1A1
SCHEMBL2662291 0.73 GCK (0.41) MAPTTP53SCD
SCHEMBL27797251 0.73 LMNA (0.36) MAPTTP53GRM4SCD
SCHEMBL27797247 0.73 LMNA (0.35) MAPTTP53GRM4SCD
SCHEMBL2661902 0.72 MEN1 (0.45) MAPTMEN1KMT2ATP53NPC1

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
US-8299115-B2 Pyrrole-2-carboxamide derivatives as glucokinase activators, their process and pharmaceutical application ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2012-10-30 US disclosed