SCHEMBL5300

SCHEMBL5300

CCNC(=O)Oc1cc2ccc(F)c(C)c2nc1N1CCNC(=O)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 7/20 0.34
POLB P06746 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
IKBKB O14920 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PRKCH P24723 1/20 0.32
PRKCE Q02156 1/20 0.32
PDE7A Q13946 1/20 0.32
SOS1 Q07889 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
KCNH2 Q12809 1/20 0.32
GRIA1 P42261 1/20 0.32

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
SCHEMBL8073 0.83 KMT2A (0.36) POLBMEN1KMT2AKDM4EGAA
SCHEMBL11318 0.79 TP53 (0.41) OPRK1KDM4EMAPT
SCHEMBL7863 0.78 PIK3CD (0.38) OPRK1KDM4EIKBKBPRKCHPRKCE
SCHEMBL5299 0.75 SOS1 (0.38) OPRK1KDM4EPRKCHPRKCESOS1
SCHEMBL861347 0.75 PIK3CD (0.41) OPRK1POLBKDM4EGAAMAPT
SCHEMBL9733 0.74 MEN1 (0.37) POLBMEN1KMT2AKDM4EGAA
SCHEMBL14480684 0.73 SOS1 (0.37) OPRK1KDM4EPRKCHPRKCESOS1
SCHEMBL14480681 0.73 SOS1 (0.37) OPRK1KDM4EPRKCHPRKCESOS1
SCHEMBL11850 0.69 MEN1 (0.42) POLBMEN1KMT2AKDM4EGAA
SCHEMBL1728693 0.69 KDM4E (0.38) POLBMEN1KMT2AKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432784-A1 FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma, S.A. (BE) 2012-03-28 EP disclosed
WO-2011058109-A1 FUSED BICYCLIC PYRROLE AND IMIDAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2011-05-19 WO disclosed
WO-2010133836-A1 FUSED BICYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2010-11-25 WO disclosed