SCHEMBL2572026

SCHEMBL2572026

Cc1cc(Cl)ccc1NC(=O)Nc1cn(Cc2ccccc2)c(OC(=O)O)n1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 7/20 0.48
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BRD4 O60885 1/20 0.42
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDR P35968 1/20 0.41
RAF1 P04049 1/20 0.41
MAPT P10636 2/20 0.40
TP53 P04637 1/20 0.39
GRIK1 P39086 1/20 0.39
ALOX5 P09917 1/20 0.39
EPHX2 P34913 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
SCHEMBL2567127 0.89 GRIK1 (0.42) P2RX7LMNAKMT2AGAARAF1
SCHEMBL2565938 0.86 ALOX5 (0.40) P2RX7POLBSMN1; SMN2GAAL3MBTL1
SCHEMBL2569125 0.85 MAPT (0.39) P2RX7POLBKMT2ASMN1; SMN2GAA
SCHEMBL2568640 0.85 MAPT (0.39) POLBLMNAKMT2ASMN1; SMN2GAA
SCHEMBL2572024 0.85 P2RX7 (0.48) P2RX7POLBLMNAKMT2ASMN1; SMN2
SCHEMBL2572466 0.85 MAPK1 (0.37) P2RX7POLBKMT2ASMN1; SMN2RAF1
SCHEMBL2570875 0.85 MAPK1 (0.37) P2RX7POLBKMT2ASMN1; SMN2KDR
SCHEMBL2570520 0.85 MEN1 (0.39) POLBLMNAKMT2ASMN1; SMN2GAA
SCHEMBL13197798 0.78 P2RX7 (0.45) P2RX7POLBLMNAKMT2ASMN1; SMN2
SCHEMBL13197922 0.77 LMNA (0.48) LMNASMN1; SMN2GAAMAPT

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-1732901-B1 ANTIVIRAL 4-AMINOCARBONYLAMINO-SUBSTITUTED IMIDAZOLE COMPOUND AICURIS GMBH & CO KG (DE) 2011-11-02 EP disclosed