SCHEMBL5115545

SCHEMBL5115545

COC(=O)n1cc(C(N)=O)c2c(Oc3cc(N)ncn3)cccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK8 P45983 2/20 0.37
MAPK10 P53779 2/20 0.37
MET P08581 3/20 0.36
KDR P35968 4/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
BRAF P15056 1/20 0.35
MAPK14 Q16539 1/20 0.35
TNNI3K Q59H18 1/20 0.35
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
FLT1 P17948 1/20 0.33
FLT4 P35916 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
JAK2 O60674 2/20 0.33

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
SCHEMBL5115137 0.78 KDR (0.43) MEN1KMT2AMAPK8MAPK10MET
SCHEMBL5108423 0.69 KDR (0.45) METKDRBRAFMAPK14TNNI3K
SCHEMBL5101356 0.65 KDM4E (0.41) MEN1KMT2AMAPK8MAPK10MET
SCHEMBL6744799 0.65 MEN1 (0.40) MEN1KMT2AMAPK8MAPK10MET
SCHEMBL6744796 0.65 MEN1 (0.40) MEN1KMT2AMAPK8MAPK10MET
SCHEMBL21232719 0.62 ABCG2 (0.49) KMT2AMAPTALDH1A1
SCHEMBL15915566 0.60 ALOX5AP (0.48) MEN1KMT2AMETKDRNPC1
SCHEMBL24729168 0.59 KMT2A (0.48) MEN1KMT2ALMNAMAPTALDH1A1
SCHEMBL2706563 0.58 KDR (0.43) MEN1KMT2AKDRNPC1RAB9A
SCHEMBL6185372 0.58 KMT2A (0.40) MEN1KMT2AMAPTALDH1A1

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-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

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-20070004764-A1 Nitrogen-containing aromatic derivatives NR0B2, NR0B1, NR4A1 MEN1 3535/4885KMT2A 986/4885MAPK8 2266/4885

“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.