SCHEMBL13449359

SCHEMBL13449359

CCOc1cnc(-c2cccc(C(C)c3nn(-c4cnn(CC)c4)ccc3=O)c2)nc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.32
FGFR3 P22607 1/20 0.32
KDR P35968 1/20 0.32
ALDH1A1 P00352 1/20 0.31
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30

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
SCHEMBL12517951 0.93 RXRA (0.34) METFGFR3KDR
SCHEMBL13274715 0.93 GRIA1 (0.36) MET
SCHEMBL13449368 0.92 ALKBH1 (0.32) MET
SCHEMBL13449360 0.92 MET (0.33) MET
SCHEMBL13275015 0.92 MET (0.32) METFGFR3KDRALDH1A1
SCHEMBL13449367 0.92 DUT (0.32) MET
SCHEMBL12517964 0.91 ALKBH1 (0.37) ALDH1A1
SCHEMBL2266777 0.90 MET (0.35) METFGFR3KDRKEAP1NFE2L2
SCHEMBL13449372 0.90 PFKFB3 (0.33) MET
SCHEMBL2266636 0.90 HSD17B13 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 US disclosed
US-20120264735-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. 2012-10-18 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-20120264735-A1 TYROSINE KINASE INHIBITORS ABL1, MET, ERBB2 MET 2/4885FGFR3 124/4885KDR 131/4885

“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.