SCHEMBL3930153

SCHEMBL3930153

CC(CC#N)c1cccc(C(=O)Nc2ccc(Cl)c(C(=O)Nc3cncc(CO)c3)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 13/20 0.51
BRAF P15056 7/20 0.47
CYP2C9 P11712 4/20 0.47
JAK2 O60674 1/20 0.43
PDGFRB P09619 1/20 0.43
FGFR1 P11362 1/20 0.43
EPHB4 P54760 1/20 0.43
PTK2 Q05397 1/20 0.43
MAPK14 Q16539 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3943927 0.91 BRAF (0.56) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL3934263 0.87 CSF1R (0.59) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL3933564 0.82 CSF1R (0.47) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL3930148 0.82 BRAF (0.70) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL3933211 0.78 CSF1R (0.72) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL4170151 0.73 BRAF (0.53) BRAFCYP2C9MAPK14
SCHEMBL3638332 0.72 KMT2A (0.58) MEN1LMNAMAPTMAPK1HTT
SCHEMBL3943923 0.72 BRAF (0.84) CSF1RBRAFCYP2C9JAK2PDGFRB
SCHEMBL3933651 0.72 BRAF (0.81) CSF1RBRAFCYP2C9MAPK14
SCHEMBL27720424 0.72 CSF1R (0.69) CSF1RBRAFCYP2C9JAK2PDGFRB

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