SCHEMBL14634800

SCHEMBL14634800

CC(C)(C)OC(=O)NCCCNC(=O)c1cc(Br)n2ncnc(N)c12

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 8/20 0.67
▸ CSNK2A1 P68400 8/20 0.67
▸ CSNK1D P48730 1/20 0.42
▸ RIPK1 Q13546 6/20 0.39
▸ STK17B O94768 1/20 0.38
▸ STK17A Q9UEE5 1/20 0.38
▸ CCNC P24863 1/20 0.38
▸ CDK8 P49336 1/20 0.38
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37

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
SCHEMBL12283230 0.88 CSNK2A2 (0.67) CSNK2A2CSNK2A1CSNK1DRIPK1STK17B
SCHEMBL12283706 0.83 CSNK2A2 (0.95) CSNK2A2CSNK2A1
SCHEMBL14654945 0.82 CSNK2A2 (0.53) CSNK2A2CSNK2A1RIPK1
SCHEMBL12537596 0.73 NTRK1 (0.41) CSNK2A2CSNK2A1CSNK1D
SCHEMBL29799705 0.71 CSNK1D (0.48) CSNK2A2CSNK2A1CSNK1DSTK17BSTK17A
SCHEMBL21366005 0.71 CSNK1D (0.48) CSNK2A2CSNK2A1CSNK1DSTK17BSTK17A
SCHEMBL19279707 0.70 CSNK2A2 (0.39) CSNK2A2CSNK2A1
SCHEMBL14635296 0.68 CSNK2A2 (0.68) CSNK2A2CSNK2A1
SCHEMBL14635298 0.68 CSNK2A2 (0.68) CSNK2A2CSNK2A1
SCHEMBL14635504 0.68 CSNK2A2 (1.00) CSNK2A2CSNK2A1

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-8791257-B2 Substituted pyrrolotriazines as protein kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-07-29 — — US disclosed
US-8791257-B2 Substituted pyrrolotriazines as protein kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2014-07-29 — — US disclosed
US-20130023514-A1 SUBSTITUTED PYRROLOTRIAZINES AS PROTEIN KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-24 — — 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-20130023514-A1 SUBSTITUTED PYRROLOTRIAZINES AS PROTEIN KINASE INHIBITORS STK25, MAP3K15, MAP3K5 CSNK2A2 123/4885CSNK2A1 84/4885CSNK1D 364/4885

“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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