SCHEMBL4314547

SCHEMBL4314547

COC(=O)c1cncc(NCCc2cccc(NC(=O)c3cccc(C)c3)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.51
SIRT1 Q96EB6 1/20 0.51
SIRT3 Q9NTG7 1/20 0.51
CSF1R P07333 1/20 0.51
RET P07949 1/20 0.51
PDGFRB P09619 1/20 0.51
KIT P10721 1/20 0.51
SRC P12931 1/20 0.51
PDGFRA P16234 1/20 0.51
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51
KDR P35968 1/20 0.51
FRK P42685 1/20 0.51
DDR1 Q08345 1/20 0.51
GPR17 Q13304 1/20 0.49
KCNK3 O14649 8/20 0.48
KCNK9 Q9NPC2 6/20 0.48
KCNH2 Q12809 1/20 0.47
BRAF P15056 1/20 0.46
GRM5 P41594 2/20 0.46

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
SCHEMBL4323640 0.88 CSF1R (0.66) SIRT2SIRT1SIRT3CSF1RRET
SCHEMBL4314543 0.85 BRAF (0.52) SIRT2SIRT1SIRT3CSF1RRET
SCHEMBL3474249 0.80 CSF1R (0.78) CSF1RRETPDGFRBKITSRC
SCHEMBL3474248 0.80 CSF1R (0.78) CSF1RRETPDGFRBKITSRC
SCHEMBL4324513 0.80 CSF1R (0.66) CSF1RRETPDGFRBKITSRC
SCHEMBL13340328 0.78 CSF1R (0.65) SIRT2SIRT1SIRT3CSF1RRET
SCHEMBL4317671 0.76 CSF1R (0.53) CSF1RRETPDGFRBKITSRC
SCHEMBL27167178 0.75 CSF1R (0.67) CSF1RRETPDGFRBKITSRC
SCHEMBL4318780 0.75 KCNK3 (0.48) SIRT2SIRT1SIRT3KCNK3KCNK9
SCHEMBL4318196 0.74 CSF1R (0.66) CSF1RRETPDGFRBKITSRC

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-2099774-A1 INHIBITORS OF KINASE ACTIVITY Cytopia Research Pty Ltd (AU) 2009-09-16 EP disclosed
WO-2008058341-A1 INHIBITORS OF KINASE ACTIVITY CYTOPIA RESEARCH PTY LTD (AU) 2008-05-22 WO disclosed