SCHEMBL726666

SCHEMBL726666

COc1ccnc(C(=O)NCC(C)(C)n2nc(-c3ccc(C)cc3)c3c(N)ncnc32)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 3/20 0.70
RET P07949 7/20 0.52
KDR P35968 7/20 0.52
SRC P12931 6/20 0.52
EGFR P00533 5/20 0.52
ABL1 P00519 4/20 0.52
BTK Q06187 4/20 0.52
MTOR P42345 2/20 0.52
KDM4E B2RXH2 2/20 0.52
PLK4 O00444 1/20 0.52
ROCK2 O75116 1/20 0.52
PRKD3 O94806 1/20 0.52
MAP4K4 O95819 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
ERBB2 P04626 1/20 0.52
INSR P06213 1/20 0.52
LCK P06239 1/20 0.52
FYN P06241 1/20 0.52
CSF1R P07333 1/20 0.52

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
SCHEMBL727113 0.93 RIPK2 (0.67) RIPK2RETKDRSRCEGFR
SCHEMBL728150 0.92 RIPK2 (0.77) RIPK2RETKDRSRCEGFR
SCHEMBL15114673 0.91 RIPK2 (0.66) RIPK2RETKDRSRCEGFR
SCHEMBL726591 0.88 RIPK2 (0.72) RIPK2RETKDRSRCEGFR
SCHEMBL726858 0.88 RIPK2 (0.72) RIPK2RETKDRSRCEGFR
SCHEMBL726638 0.88 RIPK2 (0.72) RIPK2RETKDRSRCEGFR
SCHEMBL726399 0.88 RIPK2 (0.71) RIPK2RETKDRSRCEGFR
SCHEMBL726721 0.86 RIPK2 (0.77) RIPK2RETKDRSRCEGFR
SCHEMBL15114632 0.85 RIPK2 (0.73) RIPK2RETKDRSRCEGFR
SCHEMBL728531 0.85 RIPK2 (0.77) RIPK2RETKDRSRCEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590982-B1 PROTEIN KINASE INHIBITORS AND METHODS OF TREATMENT THE WALTER AND ELIZA HALL INST OF MEDICAL RES (AU) 2017-08-23 EP disclosed
US-8962830-B2 Protein kinase inhibitors and methods of treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2015-02-24 US disclosed
US-8962830-B2 Protein kinase inhibitors and methods of treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2015-02-24 US disclosed
US-20130184274-A1 Protein Kinase Inhibitors and Methods of Treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2013-07-18 US disclosed
US-20130184274-A1 Protein Kinase Inhibitors and Methods of Treatment THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2013-07-18 US disclosed
WO-2012003544-A1 PROTEIN KINASE INHIBITORS AND METHODS OF TREATMENT THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) 2012-01-12 WO 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-20130184274-A1 Protein Kinase Inhibitors and Methods of Treatment PRKDC, PRKACA, PRKX RIPK2 634/4885RET 410/4885KDR 1720/4885

“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.