SCHEMBL14738237

SCHEMBL14738237

CCCn1nc(-c2cnc3c(n2)c(C(=O)O)cn3COCC[Si](C)(C)C)c2ccc(Cl)cc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 6/20 0.39
KDM4C Q9H3R0 5/20 0.38
DGAT1 O75907 2/20 0.35
KMO O15229 1/20 0.34
DHODH Q02127 1/20 0.34
JAK2 O60674 2/20 0.34
JAK1 P23458 2/20 0.34
PTPN1 P18031 1/20 0.34
MAPT P10636 1/20 0.33
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32

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
SCHEMBL14737956 0.94 KDM4C (0.44) SYKKDM4CDGAT1KMODHODH
SCHEMBL14737463 0.93 SYK (0.40) SYKKDM4CDGAT1KMOJAK2
SCHEMBL14737694 0.92 SYK (0.38) SYKKDM4CDGAT1KMOJAK2
SCHEMBL14737410 0.91 SYK (0.48) SYKKDM4CDGAT1JAK2JAK1
SCHEMBL14737753 0.90 KDM4C (0.38) SYKKDM4CKMOJAK2
SCHEMBL14737970 0.90 SYK (0.37) SYKKDM4CDGAT1KMODHODH
SCHEMBL14738715 0.86 SYK (0.41) SYKKDM4CDGAT1DHODHJAK2
SCHEMBL14737316 0.86 SYK (0.35) SYKKDM4CDGAT1JAK2JAK1
SCHEMBL14738419 0.84 SYK (0.49) SYKKDM4CDGAT1JAK2JAK1
SCHEMBL14755202 0.84 SYK (0.48) SYKKDM4CDGAT1JAK2JAK1

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-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 SYK 1/4885KDM4C 1619/4885DGAT1 4426/4885

“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.