SCHEMBL25857996

SCHEMBL25857996

Cc1ccn(Cc2cc(Cl)cc(CS)c2)c(=O)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
POLB P06746 1/20 0.42
MAPK14 Q16539 1/20 0.37
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KLKB1 P03952 2/20 0.35
DBH P09172 1/20 0.34
ADORA2A P29274 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL25853512 0.83 KLKB1 (0.44) MAPTTP53POLBMAPK14KMT2A
SCHEMBL21201593 0.78 MAPT (0.61) MAPTTP53POLBMAPK14KMT2A
SCHEMBL25852695 0.78 MAPT (0.43) MAPTTP53POLBMAPK14KMT2A
SCHEMBL1346298 0.77 MAPK14 (0.58) MAPTTP53POLBMAPK14KMT2A
SCHEMBL21419979 0.75 MAPT (0.49) MAPTTP53POLBMAPK14KMT2A
SCHEMBL21201592 0.75 MAPT (0.45) MAPTTP53POLBMAPK14KDM4E
SCHEMBL25857254 0.74 MAPT (0.42) MAPTTP53POLBMAPK14KMT2A
SCHEMBL4280056 0.74 MAPT (0.43) MAPTTP53POLBMAPK14KMT2A
SCHEMBL29348734 0.74 ACHE (0.48) MAPTTP53POLBMAPK14KMT2A
SCHEMBL27383784 0.72 POLB (0.59) MAPTTP53POLBMAPK14KMT2A

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-4212531-A1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV Discovery (FR) 2023-07-19 EP disclosed