SCHEMBL4634044

SCHEMBL4634044

COC(=O)Oc1nscc1NC(=O)c1ccc(Cl)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.50
MEN1 O00255 7/20 0.50
KDM4E B2RXH2 6/20 0.50
TSHR P16473 1/20 0.50
POLB P06746 1/20 0.47
ALDH1A1 P00352 5/20 0.47
HPGD P15428 5/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
NPC1 O15118 9/20 0.44
RAB9A P51151 9/20 0.44
NPSR1 Q6W5P4 3/20 0.44
CASP1 P29466 2/20 0.44
MAPT P10636 2/20 0.44
TP53 P04637 2/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
MAPK1 P28482 1/20 0.44
CASP7 P55210 1/20 0.44
LMNA P02545 2/20 0.44

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
SCHEMBL4633171 0.88 KMT2A (0.46) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL3607746 0.81 KMT2A (0.60) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL4634518 0.80 KMT2A (0.52) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL4633520 0.80 KMT2A (0.53) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL3616663 0.77 SMN1; SMN2 (0.50) KMT2AMEN1KDM4ETSHRALDH1A1
SCHEMBL4633510 0.75 KMT2A (0.65) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL4633165 0.75 KMT2A (0.49) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL4633505 0.75 KMT2A (0.49) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL3614428 0.72 KMT2A (0.61) KMT2AMEN1KDM4ETSHRPOLB
SCHEMBL4633611 0.69 KMT2A (0.48) KMT2AMEN1KDM4ETSHRPOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1928868-A1 IMINOOXAZOLIDINE DERIVATIVES AND USE THEREOF Bayer HealthCare AG (DE) 2008-06-11 EP disclosed
WO-2007028520-A1 IMINOOXAZOLIDINE DERIVATIVES AND USE THEREOF BAYER HEALTHCARE AG (DE) 2007-03-15 WO disclosed