SCHEMBL20166186

SCHEMBL20166186

COc1cnc(N2CCC(C(=O)N3N=CCC3c3cc(F)ccc3F)CC2)nc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 16/20 0.50
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC6A9 P48067 1/20 0.40
NTRK1 P04629 1/20 0.40

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
SCHEMBL20166184 1.00 RIPK1 (0.50) RIPK1KDM4EMEN1TP53TSHR
SCHEMBL20166581 0.86 RIPK1 (0.51) RIPK1SLC6A9
SCHEMBL20166577 0.86 RIPK1 (0.51) RIPK1SLC6A9
SCHEMBL20168906 0.83 RIPK1 (0.53) RIPK1
SCHEMBL20168907 0.83 RIPK1 (0.53) RIPK1
SCHEMBL20166095 0.81 RIPK1 (0.77) RIPK1
SCHEMBL20166100 0.81 RIPK1 (0.77) RIPK1
SCHEMBL20166537 0.80 RIPK1 (0.51) RIPK1SLC6A9NTRK1
SCHEMBL20166540 0.80 RIPK1 (0.51) RIPK1SLC6A9NTRK1
SCHEMBL20166505 0.79 RIPK1 (0.48) RIPK1KDM4ENTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190345138-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 US disclosed
EP-3541813-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2019-09-25 EP disclosed
WO-2018092089-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-05-24 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-20190345138-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K1 RIPK1 440/4885KDM4E 635/4885MEN1 1705/4885

“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.