SCHEMBL20049924

SCHEMBL20049924

Cc1ccc2c(c1)OC[C@H](NC(O)OC(C)(C)C)C(=O)N2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.36
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 2/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
HTT P42858 1/20 0.32
PAX8 Q06710 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL20344576 1.00 RIPK1 (0.36) RIPK1USP2GAATSHRKMT2A
SCHEMBL18745026 0.87 RIPK1 (0.36) RIPK1
SCHEMBL1561585 0.79 GAA (0.51) RIPK1USP2GAATSHR
SCHEMBL1561583 0.79 GAA (0.51) RIPK1USP2GAATSHR
SCHEMBL21123518 0.77 RIPK1 (0.40) RIPK1
SCHEMBL20049926 0.75 RIPK1 (0.34) RIPK1
SCHEMBL17332801 0.75 RIPK1 (0.38) RIPK1GAAKMT2AMEN1
SCHEMBL17332799 0.75 RIPK1 (0.38) RIPK1GAAKMT2AMEN1
SCHEMBL17333056 0.74 RIPK1 (0.38) RIPK1USP2GAA
SCHEMBL15565514 0.74 RIPK1 (0.38) RIPK1USP2GAA

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-20180098998-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-12 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-20180098998-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS CNKSR1, ARAF, MAP4K2 RIPK1 387/4885USP2 2441/4885GAA 3581/4885

“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.