SCHEMBL16887499

SCHEMBL16887499

N#CCCC#Cc1ccc(NC(=O)Cc2cccc(OC(F)(F)F)c2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 7/20 0.43
▸ RIPK3 Q9Y572 2/20 0.42
▸ GLS O94925 7/20 0.41
▸ P2RY14 Q15391 2/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ BRAF P15056 1/20 0.39
▸ NLRP3 Q96P20 1/20 0.39

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
SCHEMBL16887486 0.83 GLS (0.47) GLSBRAF
SCHEMBL16879523 0.82 GLS (0.49) RIPK1RIPK3GLSNLRP3
SCHEMBL16887479 0.82 BRAF (0.43) GLSP2RY14BRAFNLRP3
SCHEMBL16879071 0.82 GLS (0.43) RIPK1RIPK3GLSP2RY14BRAF
SCHEMBL16887490 0.78 GLS (0.46) GLSP2RY14
SCHEMBL16879519 0.78 NPC1 (0.52) RIPK1RIPK3GLSP2RY14BRAF
SCHEMBL15728060 0.78 GLS (0.53) GLS
SCHEMBL29679027 0.78 GLS (0.53) GLS
SCHEMBL16887474 0.77 BRAF (0.48) GLSP2RY14BRAFNLRP3
SCHEMBL16887482 0.76 GLS (0.46) GLSP2RY14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160297761-A1 NOVEL INHIBITORS OF GLUTAMINASE RHIZEN PHARMACEUTICALS AG (CH) 2016-10-13 — — US disclosed
US-20160297761-A1 NOVEL INHIBITORS OF GLUTAMINASE RHIZEN PHARMACEUTICALS AG (CH) 2016-10-13 — — US disclosed
US-20160297761-A1 NOVEL INHIBITORS OF GLUTAMINASE RHIZEN PHARMACEUTICALS AG (CH) 2016-10-13 — — US disclosed
WO-2015101958-A2 NOVEL INHIBITORS OF GLUTAMINASE RHIZEN PHARMACEUTICALS SA (CH) 2015-07-09 — — 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-20160297761-A1 NOVEL INHIBITORS OF GLUTAMINASE GLS, GLS2, GLUL RIPK1 2126/4885RIPK3 2079/4885GLS 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.

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