SCHEMBL20166537

SCHEMBL20166537

NC(=O)c1ccnc(N2CCC(C(=O)N3N=CC[C@H]3c3cc(F)ccc3F)CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 14/20 0.51
HTR1A P08908 2/20 0.42
JAK2 O60674 1/20 0.39
NTRK1 P04629 1/20 0.39
SLC6A9 P48067 1/20 0.39
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38

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
SCHEMBL20166540 1.00 RIPK1 (0.51) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638897 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22644516 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638850 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638974 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638852 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638804 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638805 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL22638952 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9
SCHEMBL30968257 0.88 NR1H2 (0.39) RIPK1HTR1AJAK2NTRK1SLC6A9

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
US-20200062735-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-02-27 US disclosed
US-20190345138-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 US disclosed
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
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 (2 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 440/4885HTR1A 2170/4885JAK2 113/4885
US-20200062735-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS RIPK1, RIPK4, RIPK3 RIPK1 1/4885HTR1A 4158/4885JAK2 1921/4885

“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.