SCHEMBL8534258

SCHEMBL8534258

NN=CNc1cccc(OC(=O)C(N)(Oc2ccccc2)C(N)=O)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
MEN1 O00255 1/20 0.33
PLAU P00749 1/20 0.33
F13A1 P00488 1/20 0.32
TGM2 P21980 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
MAPK1 P28482 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NLRP3 Q96P20 1/20 0.32
CCNA2 P20248 1/20 0.31

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
SCHEMBL8429249 0.81 MAPK1 (0.33) KMT2ABCHEACHEMAPK1
SCHEMBL8429109 0.78 MEN1 (0.37) KMT2AMEN1MAPK1CA1CA2
SCHEMBL8432262 0.71 ERCC5 (0.38) KMT2AMEN1MAPK1CA1CA2
SCHEMBL8432297 0.70 RAB9A (0.43) KMT2AMEN1MAPK1NPC1RAB9A
SCHEMBL8542420 0.70 MAPK1 (0.37) KMT2AMEN1PLAUMAPK1NPC1
SCHEMBL8534298 0.69 KMT2A (0.34) KMT2AMEN1TGM2MAPK1NPC1
SCHEMBL6777725 0.66 RAB9A (0.50) KMT2AMEN1CA1CA2NPC1
SCHEMBL7863184 0.66 MAPK1 (0.56) KMT2AMEN1MAPK1CA12CA1
SCHEMBL19443946 0.64 ALDH1A1 (0.48) KMT2AMAPK1CA1CA2NPC1
SCHEMBL5251358 0.63 PARP10 (0.44) KMT2AMEN1SMN1; SMN2

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-5773646-A INTEGRIN INHIBITORS G. D. SEARLE & CO. (US) 1998-06-30 US disclosed