SCHEMBL3933053

SCHEMBL3933053

Cc1ccc(NC(=O)c2cncc(N3CCOCC3)c2)cc1C(=O)Nc1cccnc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
TP53 P04637 1/20 0.60
BRAF P15056 13/20 0.59
MAPT P10636 1/20 0.58
POLB P06746 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CSF1R P07333 2/20 0.55
RAF1 P04049 1/20 0.53
MAPK14 Q16539 1/20 0.52
HTT P42858 1/20 0.52

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
SCHEMBL3941868 0.91 BRAF (0.61) SMN1; SMN2TP53BRAFMAPTPOLB
SCHEMBL3934865 0.84 TEK (0.64) BRAFCSF1RRAF1MAPK14
SCHEMBL27720606 0.81 BRAF (0.79) BRAFCSF1RMAPK14
SCHEMBL27699867 0.80 BRAF (0.69) BRAFCSF1RRAF1MAPK14
SCHEMBL3932223 0.79 BRAF (0.71) SMN1; SMN2BRAFMAPTPOLBMEN1
SCHEMBL13492316 0.78 ABL1 (0.68) BRAFCSF1RRAF1MAPK14
SCHEMBL3941714 0.77 BRAF (0.83) BRAFCSF1RMAPK14
SCHEMBL3937724 0.77 CSF1R (0.83) BRAFCSF1RMAPK14
SCHEMBL13162883 0.76 ABL1 (0.56) SMN1; SMN2TP53BRAFMAPTPOLB
SCHEMBL3936032 0.76 CSF1R (0.66) SMN1; SMN2TP53BRAFMEN1KMT2A

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
EP-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed