SCHEMBL4069130

SCHEMBL4069130

FC(F)(F)c1cnc(Cl)nc1Nc1cc(C2CC2)n[nH]1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.45
ULK1 O75385 8/20 0.36
LRRK2 Q5S007 2/20 0.35
PRKCQ Q04759 2/20 0.35
ROCK2 O75116 2/20 0.35
PTK2B Q14289 2/20 0.34
CDK1 P06493 1/20 0.33
KMT2A Q03164 1/20 0.33
ALK Q9UM73 1/20 0.33
ULK2 Q8IYT8 1/20 0.33

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
SCHEMBL588427 0.84 KMT2A (0.47) IGF1RROCK2KMT2A
SCHEMBL3852710 0.83 IGF1R (0.41) IGF1RLRRK2PRKCQROCK2KMT2A
SCHEMBL4073673 0.81 IGF1R (0.43) IGF1RKMT2A
SCHEMBL589661 0.81 IGF1R (0.46) IGF1R
SCHEMBL11938388 0.81 IGF1R (0.72) IGF1RULK1LRRK2CDK1
SCHEMBL30010241 0.77 NTRK1 (0.52) IGF1R
SCHEMBL3763586 0.76 IGF1R (0.38) IGF1RKMT2A
SCHEMBL4068340 0.74
SCHEMBL12784225 0.72 CCNA2 (0.44) IGF1RULK1LRRK2ALK
SCHEMBL27815652 0.71 IGF1R (0.33) IGF1R

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-1686999-B1 PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2009-07-01 EP disclosed
CN-1905884-A Pyrazole derivatives as inhibitors of receptor tyrosyne kinases ASTRAZENECA AB (SE) 2007-01-31 CN disclosed