SCHEMBL14737296

SCHEMBL14737296

Cn1nc(-c2cnc3c(n2)c(C(=O)O)cn3COCC[Si](C)(C)C)c2cc(F)c(F)cc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.35
SCN9A Q15858 2/20 0.34
CYP2C9 P11712 2/20 0.34
DGAT1 O75907 3/20 0.33
SCN5A Q14524 1/20 0.33
LMNA P02545 1/20 0.32
ATP6V1B2 P21281 1/20 0.32
TBXA2R P21731 1/20 0.32
EDNRA P25101 1/20 0.32
TARBP2 Q15633 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
SCHEMBL14737345 0.90 SYK (0.46) SYKCYP2C9DGAT1
SCHEMBL14737803 0.90 SYK (0.37) SYKCYP2C9DGAT1
SCHEMBL14737410 0.87 SYK (0.48) SYKCYP2C9DGAT1
SCHEMBL14738715 0.87 SYK (0.41) SYKDGAT1
SCHEMBL14737441 0.87 SYK (0.33) SYKCYP2C9DGAT1
SCHEMBL14737251 0.86 DGAT1 (0.38) SYKDGAT1
SCHEMBL14746965 0.86 SYK (0.40) SYKSCN9ACYP2C9DGAT1SCN5A
SCHEMBL14737636 0.86 SYK (0.40) SYKDGAT1
SCHEMBL14738585 0.86 SYK (0.50) SYKCYP2C9DGAT1
SCHEMBL14737172 0.85 JAK2 (0.40) SYKCYP2C9DGAT1

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
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US 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 1/4885SCN9A 4643/4885CYP2C9 3710/4885

“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.