SCHEMBL2566472

SCHEMBL2566472

CN1CCc2ccc(NC(=O)OC3(NC(=O)c4ccc(Cl)s4)CC(O)C(OC=O)C3)cc2CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
F10 P00742 8/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MEN1 O00255 2/20 0.33
NFKB1 P19838 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
POLB P06746 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL2569473 0.91 KMT2A (0.41) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2571066 0.88 KMT2A (0.40) KMT2ALMNAMAPK1F10NPC1
SCHEMBL3033534 0.86 KMT2A (0.37) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2565621 0.84 KMT2A (0.44) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2571524 0.83 KMT2A (0.43) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2567151 0.83 KMT2A (0.43) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2570785 0.83 KMT2A (0.43) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2567239 0.82 KMT2A (0.42) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2571579 0.81 KMT2A (0.40) KMT2ALMNAMAPK1F10NPC1
SCHEMBL2568491 0.81 WDR91 (0.40) KMT2ALMNAMAPK1F10NPC1

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-1899330-B9 SUBSTITUTED GLYCINAMIDES HAVING AN ANTITHROMBOTIC AND FACTOR XA-INHIBITING EFFECT BOEHRINGER INGELHEIM INT (DE) 2011-11-09 EP disclosed
EP-1899330-B1 SUBSTITUTED GLYCINAMIDES HAVING AN ANTITHROMBOTIC AND FACTOR XA-INHIBITING EFFECT BOEHRINGER INGELHEIM INT (DE) 2010-11-24 EP disclosed