SCHEMBL4031791

SCHEMBL4031791

CCCc1cc(Nc2nc(NCc3cccnc3)ncc2Cl)n[nH]1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.79
FGFR1 P11362 10/20 0.79
KDR P35968 9/20 0.79
INSR P06213 3/20 0.55
BCL6 P41182 2/20 0.54
PKM P14618 1/20 0.45
RAD52 P43351 1/20 0.45
NTRK1 P04629 3/20 0.44
PGK1 P00558 2/20 0.43
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
AURKA O14965 2/20 0.42
PLK4 O00444 1/20 0.42
JAK2 O60674 1/20 0.42
STK10 O94804 1/20 0.42
PAK4 O96013 1/20 0.42
RET P07949 1/20 0.42
FER P16591 1/20 0.42
CSNK2A2 P19784 1/20 0.42
JAK1 P23458 1/20 0.42

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
SCHEMBL4032744 0.88 IGF1R (1.00) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4034569 0.88 IGF1R (0.66) IGF1RFGFR1KDRINSRBCL6
SCHEMBL2122674 0.85 IGF1R (0.58) IGF1RFGFR1KDRINSRBCL6
SCHEMBL4037330 0.84 IGF1R (0.67) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4038016 0.83 IGF1R (0.79) IGF1RFGFR1KDRINSRBCL6
SCHEMBL4036281 0.80 IGF1R (0.85) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4040276 0.77 FGFR1 (0.46) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4034838 0.76 IGF1R (0.78) IGF1RFGFR1KDRNTRK1AURKA
SCHEMBL2123750 0.76 IGF1R (0.85) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL2120905 0.73 IGF1R (0.74) IGF1RFGFR1KDRINSRNTRK1

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-1456182-B1 PYRIMIDINE DERIVATIVES AS MODULATORS OF INSULINE-LIKE GROWTH FACTOR-1 RECEPTOR (IGF-I) ASTRAZENECA AB (SE) 2009-03-11 EP disclosed