SCHEMBL2456065

SCHEMBL2456065

O=C(NCc1cccc(OC(F)(F)F)c1)Nc1cc(Oc2ccc3nc(NC(=O)C4CC4)sc3n2)ccc1F

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 17/20 0.65
RIPK3 Q9Y572 10/20 0.65
BRAF P15056 2/20 0.62
KDR P35968 1/20 0.57

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
SCHEMBL2452584 0.91 RIPK1 (0.64) RIPK1RIPK3BRAFKDR
SCHEMBL12333868 0.90 BRAF (0.63) RIPK1RIPK3BRAFKDR
SCHEMBL2452667 0.87 BRAF (0.65) RIPK1RIPK3BRAFKDR
SCHEMBL2454632 0.86 BRAF (0.70) RIPK1RIPK3BRAFKDR
SCHEMBL2456245 0.84 BRAF (0.64) RIPK1RIPK3BRAFKDR
SCHEMBL2455436 0.83 BRAF (0.64) RIPK1RIPK3BRAFKDR
SCHEMBL2452470 0.82 BRAF (0.69) RIPK1RIPK3BRAFKDR
SCHEMBL2455839 0.81 BRAF (0.64) RIPK1RIPK3BRAFKDR
SCHEMBL2453182 0.80 RIPK1 (0.80) RIPK1RIPK3BRAFKDR
SCHEMBL2452555 0.80 KDR (0.71) RIPK1RIPK3BRAFKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2399921-B1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2015-08-12 EP disclosed
US-8697874-B2 Heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-04-15 US disclosed
EP-2399921-A1 HETEROCYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2011-12-28 EP disclosed
US-20110237620-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-09-29 US disclosed
US-20110237620-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-09-29 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-20110237620-A1 HETEROCYCLIC COMPOUND AND USE THEREOF BRAF, NR3C2, RAF1 RIPK1 991/4885RIPK3 705/4885BRAF 1/4885

“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.