SCHEMBL3548953

SCHEMBL3548953

Cc1cccn2c(-c3ccnc(N[C@@H](C)c4ccccc4)n3)cnc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.49
MAPK13 O15264 3/20 0.48
MAPK14 Q16539 3/20 0.48
MAPK12 P53778 2/20 0.48
MAPK11 Q15759 2/20 0.48
LCK P06239 4/20 0.46
MAPK8 P45983 2/20 0.46
MAPK9 P45984 2/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
LYN P07948 1/20 0.46
MAPK1 P28482 1/20 0.46
AKT2 P31751 1/20 0.46
FLT4 P35916 1/20 0.46
FRK P42685 1/20 0.46
CSNK1A1 P48729 1/20 0.46
CSNK1D P48730 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
CSNK1G2 P78368 1/20 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
SCHEMBL3555802 0.87 FLT3 (0.54) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3555046 0.86 IDH1 (0.40) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3555283 0.85 FLT3 (0.47) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3556311 0.83 DYRK1A (0.56) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3557012 0.83 CAMK2D (0.47) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3550097 0.83 MAPK14 (0.52) FLT3MAPK13MAPK14MAPK12MAPK11
SCHEMBL3554499 0.81 IGF1R (0.39) MAPK13MAPK14MAPK12MAPK11LCK
SCHEMBL3548594 0.81 MAPK14 (0.40) MAPK13MAPK14MAPK12MAPK11LCK
SCHEMBL3551921 0.81 TP53 (0.43) MAPK13MAPK14MAPK12MAPK11LCK
SCHEMBL3552537 0.81 TP53 (0.39) MAPK13MAPK14MAPK12MAPK11LCK

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718801-B2 Substituted imidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-05-18 US disclosed
US-20080070894-A1 Novel Substituted Imidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1790650-A1 NOVEL SUBSTITUTED IMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-05-30 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080070894-A1 Novel Substituted Imidazole Derivative PLK1, CDK1, CDK11A FLT3 23/4885MAPK13 678/4885MAPK14 680/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.