SCHEMBL5113653

SCHEMBL5113653

C#CCNC(=O)n1ccc2cc(Oc3ccnc(NC(=O)NCC)c3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.42
FGFR1 P11362 11/20 0.41
GCK P35557 1/20 0.41
KDR P35968 3/20 0.40
FGF2 P09038 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39

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
SCHEMBL5107817 0.93 FGFR1 (0.46) BRAFFGFR1GCKKDRFGF2
SCHEMBL13999500 0.92 GCK (0.51) FGFR1GCKKDRFGF2FGFR4
SCHEMBL5115170 0.90 FGFR1 (0.46) FGFR1GCKFGF2FGFR4FGFR3
SCHEMBL5108286 0.89 FGFR1 (0.49) FGFR1GCKFGF2FGFR4FGFR3
SCHEMBL5102563 0.88 MAOA (0.43) BRAFFGFR1KDRFGF2FGFR4
SCHEMBL5107862 0.87 GCK (0.47) BRAFFGFR1GCKKDRJAK2
SCHEMBL5108169 0.86 GCK (0.43) BRAFFGFR1GCKKDRFGF2
SCHEMBL5104810 0.86 FGFR1 (0.45) BRAFFGFR1GCKFGF2FGFR4
SCHEMBL13999514 0.86 FGFR1 (0.45) FGFR1
SCHEMBL5101633 0.86 FGFR1 (0.41) FGFR1KDRFGF2FGFR4FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468380-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-12-23 US disclosed
US-20070004764-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-01-04 US disclosed
US-7109219-B2 Nitrogen-containing aromatic derivatives EISAI CO., LTD. (JP) 2006-09-19 US disclosed
US-20060004029-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-01-05 US disclosed
US-20050187236-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-08-25 US disclosed
EP-1522540-A1 AZAARENE DERIVATIVES Eisai Co., Ltd. (JP) 2005-04-13 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 (3 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-20060004029-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 BRAF 1488/4885FGFR1 595/4885GCK 3607/4885
US-20050187236-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 BRAF 1488/4885FGFR1 595/4885GCK 3607/4885
US-20070004764-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 BRAF 1488/4885FGFR1 595/4885GCK 3607/4885

“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.