SCHEMBL4348496

SCHEMBL4348496

CC(C)[C@@H](CN1CCCC1)NC(=O)C=Cc1c[nH]c2ncccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
HDAC1 Q13547 2/20 0.38
AXL P30530 1/20 0.38
JAK2 O60674 2/20 0.37
LYN P07948 2/20 0.37
FLT3 P36888 2/20 0.37
SYK P43405 2/20 0.37
CDC7 O00311 2/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MAP2K1 Q02750 1/20 0.36
MTNR1A P48039 1/20 0.35
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
MAPT P10636 3/20 0.35
TP53 P04637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GSK3B P49841 1/20 0.35
OPRL1 P41146 2/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35

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
SCHEMBL4348487 1.00 KMT2A (0.41) KMT2AHDAC1AXLJAK2LYN
SCHEMBL4347015 0.88 KMT2A (0.40) KMT2AHDAC1AXLCDC7HDAC6
SCHEMBL4347010 0.88 KMT2A (0.40) KMT2AHDAC1AXLCDC7HDAC6
SCHEMBL4350717 0.87 AURKA (0.46) KMT2AHDAC1AXLCDC7HDAC6
SCHEMBL4350722 0.87 AURKA (0.46) KMT2AHDAC1AXLCDC7HDAC6
SCHEMBL4355640 0.84 KMT2A (0.46) KMT2AHDAC1HDAC6MAP2K1MTNR1A
SCHEMBL4355635 0.84 KMT2A (0.46) KMT2AHDAC1HDAC6MAP2K1MTNR1A
SCHEMBL4349063 0.84 DYRK1A (0.44) KMT2AAXLFLT3CDC7PIM1
SCHEMBL4349068 0.84 DYRK1A (0.44) KMT2AAXLFLT3CDC7PIM1
SCHEMBL4355953 0.84 DYRK1A (0.44) KMT2AAXLFLT3CDC7PIM1

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-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 EP claimed
EP-2070928-A1 7-azaindol-3-ylacrylamides active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2009-06-17 EP disclosed