SCHEMBL8632291

SCHEMBL8632291

N#Cc1[nH]nc(NS(=O)(=O)c2ccccc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.46
NPSR1 Q6W5P4 3/20 0.44
MAPT P10636 3/20 0.44
MAPK1 P28482 1/20 0.44
NAT1 P18440 1/20 0.43
EDNRB P24530 1/20 0.42
EDNRA P25101 1/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.42
KDM4E B2RXH2 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
CDC7 O00311 1/20 0.41
GRM5 P41594 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
NOD1 Q9Y239 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL8633966 0.81 KDM1A (0.49) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8631094 0.81 KDM1A (0.46) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8629108 0.81 EDNRB (0.47) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8632682 0.79 KDM1A (0.46) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8635070 0.79 KDM1A (0.49) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8631594 0.78 KDM1A (0.46) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8635015 0.77 KDM1A (0.45) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8627790 0.77 MAPT (0.45) KDM1ANPSR1MAPTMAPK1NAT1
SCHEMBL8629350 0.74 SMN1; SMN2 (0.46) KDM1ANPSR1MAPTNAT1EDNRB
SCHEMBL8631602 0.74 CDC25A (0.43) KDM1ANPSR1MAPTMAPK1NAT1

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