SCHEMBL21155418

SCHEMBL21155418

Cc1cccc(Cl)c1NC(=O)c1cnc(Nc2cc(N(C)CCN)ncn2)s1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 16/20 0.64
MAPK14 Q16539 7/20 0.60
MAPK13 O15264 2/20 0.60
EGFR P00533 2/20 0.60
FYN P06241 2/20 0.60
HCK P08631 2/20 0.60
SRC P12931 2/20 0.60
JAK3 P52333 2/20 0.60
MAPK12 P53778 2/20 0.60
MAPK11 Q15759 2/20 0.60
ABL1 P00519 1/20 0.60
ERBB2 P04626 1/20 0.60
YES1 P07947 1/20 0.60
LYN P07948 1/20 0.60
FGR P09769 1/20 0.60
KIT P10721 1/20 0.60
BCR P11274 1/20 0.60

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
SCHEMBL774458 0.92 LCK (0.62) LCKMAPK14MAPK13EGFRFYN
SCHEMBL6000502 0.85 LCK (0.64) LCKMAPK14MAPK13EGFRFYN
SCHEMBL773909 0.84 LCK (0.68) LCKMAPK14MAPK13EGFRFYN
SCHEMBL14569074 0.84 LCK (0.75) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1540977 0.82 LCK (0.70) LCKMAPK14MAPK13EGFRFYN
SCHEMBL771868 0.82 LCK (0.70) LCKMAPK14MAPK13EGFRFYN
SCHEMBL14569092 0.82 LCK (0.70) LCKMAPK14MAPK13EGFRFYN
SCHEMBL773039 0.81 LCK (0.61) LCKMAPK14MAPK13EGFRFYN
SCHEMBL15891879 0.81 LCK (0.68) LCKMAPK14MAPK13EGFRFYN
SCHEMBL19390257 0.81 LCK (0.82) LCKMAPK14MAPK13EGFRFYN

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-20190210986-A1 CYCLIC PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-07-11 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-20190210986-A1 CYCLIC PROTEIN TYROSINE KINASE INHIBITORS LCK, ABL1, BTK LCK 1/4885MAPK14 183/4885MAPK13 272/4885

“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.