SCHEMBL5114627

SCHEMBL5114627

CCNC(=O)Nc1cc(Oc2ccc3c(ccn3C(=O)N3CCOCC3)c2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 14/20 0.43
BRAF P15056 2/20 0.40
PIK3CA P42336 2/20 0.40
PIK3CD O00329 1/20 0.40
MAPK1 P28482 1/20 0.39
MAPK8 P45983 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
GCK P35557 1/20 0.39
FGF2 P09038 1/20 0.38
FGFR4 P22455 1/20 0.38
FGFR3 P22607 1/20 0.38

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
SCHEMBL5107934 0.90 FGFR1 (0.44) FGFR1BRAFGCKFGF2FGFR4
SCHEMBL6038382 0.87 FGFR1 (0.44) FGFR1BRAFGCKFGFR3
SCHEMBL5108431 0.87 FGFR1 (0.42) FGFR1BRAFFGF2FGFR4FGFR3
SCHEMBL5102211 0.87 FGFR1 (0.43) FGFR1FGF2FGFR4FGFR3
SCHEMBL5107862 0.84 GCK (0.47) FGFR1BRAFGCK
SCHEMBL5107817 0.84 FGFR1 (0.46) FGFR1BRAFGCKFGF2FGFR4
SCHEMBL5101987 0.84 MAPK1 (0.48) FGFR1BRAFPIK3CAPIK3CDMAPK1
SCHEMBL5101386 0.83 MAPK1 (0.44) FGFR1PIK3CAMAPK1MAPK8MAPK9
SCHEMBL6513255 0.83 FGFR1 (0.42) FGFR1PIK3CAPIK3CDGCKFGFR3
SCHEMBL5108286 0.83 FGFR1 (0.49) FGFR1GCKFGF2FGFR4FGFR3

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 9 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-7468380-B2 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-12-23 US disclosed
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-20070004764-A1 Nitrogen-containing aromatic derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-01-04 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

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 FGFR1 595/4885BRAF 1488/4885PIK3CA 4313/4885
US-20050187236-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 FGFR1 595/4885BRAF 1488/4885PIK3CA 4313/4885
US-20070004764-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 FGFR1 595/4885BRAF 1488/4885PIK3CA 4313/4885

“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.