SCHEMBL8628554

SCHEMBL8628554

N#Cc1c(-c2ccc(Cl)cc2)c(NS(=O)(=O)c2ccccc2)nn1CCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.41
KDM1A O60341 2/20 0.40
EDNRB P24530 1/20 0.39
EDNRA P25101 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
NRP1 O14786 1/20 0.39
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 4/20 0.38
MEN1 O00255 3/20 0.38
LMNA P02545 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
POLB P06746 2/20 0.38
ATM Q13315 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL8631602 0.91 CDC25A (0.43) PRMT1KDM1AEDNRBEDNRACDC25A
SCHEMBL8634744 0.90 GAA (0.44) NRP1ALDH1A1GAAMAPTMEN1
SCHEMBL8629951 0.87 MAPT (0.43) KDM1AEDNRBEDNRACDC25ACDC25B
SCHEMBL8629350 0.87 SMN1; SMN2 (0.46) KDM1AEDNRBEDNRAALDH1A1GAA
SCHEMBL8630563 0.85 PRMT1 (0.43) PRMT1KDM1AALDH1A1GAATP53
SCHEMBL8633160 0.84 MEN1 (0.43) KDM1AEDNRBEDNRACDC25ACDC25B
SCHEMBL8631666 0.83 EDNRB (0.42) PRMT1KDM1AEDNRBEDNRAALDH1A1
SCHEMBL8627773 0.83 PRMT1 (0.42) PRMT1KDM1AEDNRBEDNRAALDH1A1
SCHEMBL8635042 0.82 PDE9A (0.43) CDC25ACDC25BALDH1A1GAAMAPT
SCHEMBL8634716 0.81 PI4KB (0.42) KDM1AMAPT

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-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed