SCHEMBL3589397

SCHEMBL3589397

CNC(=O)c1cc(Nc2cc(NC(=O)c3cccc(C(C)(C)OC)c3)ccc2C)n(-c2cc(NCCN3CCOCC3)ncn2)n1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LCK P06239 13/20 0.51
KDR P35968 11/20 0.51
LYN P07948 10/20 0.51
SRC P12931 10/20 0.51
INSR P06213 9/20 0.51
HCK P08631 8/20 0.51
MAPK14 Q16539 6/20 0.48
BRAF P15056 3/20 0.45

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
SCHEMBL3591920 0.93 LCK (0.55) LCKKDRLYNSRCINSR
SCHEMBL3599817 0.93 LCK (0.53) LCKKDRLYNSRCINSR
SCHEMBL3595899 0.92 LCK (0.61) LCKKDRLYNSRCINSR
SCHEMBL3582918 0.92 BRAF (0.55) LCKKDRLYNSRCINSR
SCHEMBL3591172 0.91 LCK (0.52) LCKKDRLYNSRCINSR
SCHEMBL3591618 0.90 LCK (0.50) LCKKDRLYNSRCINSR
SCHEMBL3024507 0.88 LCK (0.56) LCKKDRLYNSRCINSR
SCHEMBL3596372 0.88 MAPK14 (0.55) LCKKDRLYNSRCINSR
SCHEMBL3582822 0.87 MAPK14 (0.48) LCKKDRLYNSRCINSR
SCHEMBL9967514 0.87 LCK (0.61) LCKKDRLYNSRCINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US claimed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US claimed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK LCK 3/4885KDR 13/4885LYN 12/4885

“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.