SCHEMBL1887102

SCHEMBL1887102

CCN1C(=O)N(c2ccc(F)c(NC(=O)Nc3cc(C(C)(C)C)no3)c2)Cc2cnc(NC)nc21.CNc1ncc2c(n1)N(C)C(=O)N(c1cc(NC(=O)Nc3cc(C(F)(F)F)nn3-c3ccccc3)c(F)cc1C)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.39
KDR P35968 2/20 0.39
KRAS P01116 1/20 0.39
RAF1 P04049 1/20 0.39
MAP2K2 P36507 1/20 0.39
MAP2K1 Q02750 1/20 0.39
ABL1 P00519 4/20 0.38
TNK2 Q07912 11/20 0.38
MAP4K2 Q12851 11/20 0.38
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
MAPK3 P27361 1/20 0.36
BMX P51813 5/20 0.35
BCR P11274 1/20 0.35
RIPK1 Q13546 1/20 0.35
RIPK3 Q9Y572 1/20 0.35
FGFR4 P22455 1/20 0.35
LCK P06239 1/20 0.35

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
SCHEMBL1887101 0.87 ABL1 (0.37) KDRABL1TNK2MAP4K2MAPK3
SCHEMBL1521641 0.86 TNK2 (0.48) BRAFKDRABL1TNK2MAP4K2
SCHEMBL1521906 0.86 KCNJ6 (0.46) BRAFRAF1TNK2MAP4K2MAPK13
SCHEMBL1521654 0.85 MAPK14 (0.47) BRAFABL1TNK2MAP4K2MAPK13
SCHEMBL1521661 0.84 KCNJ6 (0.47) BRAFRAF1ABL1TNK2MAP4K2
SCHEMBL1521858 0.84 BRAF (0.46) BRAFKDRKRASRAF1MAP2K2
SCHEMBL1521670 0.84 BRAF (0.51) BRAFKDRKRASRAF1MAP2K2
SCHEMBL1521734 0.83 MAPK14 (0.51) BRAFMAPK13MAPK12MAPK11MAPK14
SCHEMBL1521733 0.82 ABL1 (0.45) BRAFKDRKRASRAF1MAP2K2
SCHEMBL1521795 0.82 BRAF (0.47) BRAFKDRKRASRAF1MAP2K2

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
US-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases FLYNN DANIEL L 2011-05-19 US claimed

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-20110118271-A1 Kinase Inhibitors Useful For The Treatment Of Proliferative Diseases BRAF, PRKDC, RAF1 BRAF 1/4885KDR 500/4885KRAS 30/4885

“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.