SCHEMBL17937553

SCHEMBL17937553

Cn1cc(Nc2nc(N)nc(-c3ccnc(-n4ccc5cc(C6CC6)cc(F)c5c4=O)c3CO)n2)cn1

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.79
▸ KCNH2 Q12809 7/20 0.79
▸ CD69 Q07108 1/20 0.79

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
SCHEMBL17922225 0.89 BTK (0.79) BTKKCNH2CD69
Sofnobrutinib SCHEMBL17781672 0.88 BTK (1.00) BTKKCNH2CD69
Sofnobrutinib SCHEMBL29547553 0.88 BTK (1.00) BTKKCNH2CD69
SCHEMBL17937552 0.88 BTK (0.81) BTKKCNH2CD69
SCHEMBL17937551 0.87 BTK (0.85) BTKKCNH2CD69
Sofnobrutinib SCHEMBL17781705 0.86 BTK (0.95) BTKKCNH2CD69
SCHEMBL17937549 0.85 BTK (0.81) BTKKCNH2CD69
Sofnobrutinib SCHEMBL17781505 0.84 BTK (0.91) BTKKCNH2CD69
Sofnobrutinib SCHEMBL17819014 0.84 BTK (0.91) BTKKCNH2CD69
Sofnobrutinib SCHEMBL17781553 0.84 BTK (0.91) BTKKCNH2CD69

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-20160221991-A1 NOVEL TRIAZINE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2016-08-04 — — US disclosed
US-20160221991-A1 NOVEL TRIAZINE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2016-08-04 — — US disclosed
EP-3048102-A1 NOVEL TRIAZINE DERIVATIVE Carna Biosciences Inc. (JP) 2016-07-27 — — EP 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-20160221991-A1 NOVEL TRIAZINE DERIVATIVE BAZ2A, BAZ2B, DOT1L BTK 3033/4885KCNH2 185/4885CD69 4782/4885

“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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