SCHEMBL15206945

SCHEMBL15206945

COc1ccc(-c2nccn3nc(Nc4ccc(OC(F)(F)F)cc4)nc23)cn1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.48
PTK2 Q05397 5/20 0.48
JAK3 P52333 3/20 0.48
CHRNA7 P36544 8/20 0.44
PPARD Q03181 1/20 0.40
ABL1 P00519 2/20 0.39
KCNH2 Q12809 1/20 0.39
SCN5A Q14524 1/20 0.39
SCN9A Q15858 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
SCHEMBL21119 0.90 JAK2 (0.52) JAK2PTK2JAK3
SCHEMBL15206858 0.87 JAK2 (0.48) JAK2PTK2JAK3
SCHEMBL15207847 0.87 KCNH2 (0.47) JAK2PTK2JAK3CHRNA7ABL1
SCHEMBL20668 0.87 JAK2 (0.42) JAK2PTK2JAK3CHRNA7KCNH2
SCHEMBL31462 0.87 JAK2 (0.49) JAK2PTK2JAK3
SCHEMBL15207567 0.86 KIT (0.40) JAK2PTK2JAK3CHRNA7ABL1
SCHEMBL30618 0.85 JAK2 (0.52) JAK2PTK2JAK3
SCHEMBL19101 0.85 TRPA1 (0.44) JAK2PTK2JAK3CHRNA7ABL1
SCHEMBL20546 0.84 JAK2 (0.44) JAK2PTK2JAK3ABL1KCNH2
SCHEMBL15207000 0.83 ABL1 (0.42) JAK2PTK2JAK3CHRNA7ABL1

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-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 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-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES SYK, IRAK1, ZAP70 JAK2 5/4885PTK2 367/4885JAK3 32/4885

“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.