SCHEMBL14738174

SCHEMBL14738174

COC(=O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)c2ncc(-c3nn(C)c4ccc(O[Si](C)(C)C(C)(C)C)cc34)nc12

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.43
KCNH2 Q12809 6/20 0.33
CYP2C9 P11712 3/20 0.33
CYP2D6 P10635 3/20 0.33
PLA2G2A P14555 1/20 0.31
JAK2 O60674 3/20 0.31
JAK1 P23458 3/20 0.31
JAK3 P52333 3/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NR4A2 P43354 1/20 0.30

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
SCHEMBL14737146 0.93 SYK (0.42) SYKKCNH2CYP2C9CYP2D6JAK2
SCHEMBL14738378 0.87 SYK (0.40) SYKCYP2C9CYP2D6JAK2JAK1
SCHEMBL14737299 0.85 SYK (0.41) SYKKCNH2CYP2C9CYP2D6PLA2G2A
SCHEMBL14751644 0.84 SYK (0.44) SYKKCNH2CYP2C9JAK2JAK1
SCHEMBL14737942 0.83 SYK (0.39) SYKKCNH2CYP2C9CYP2D6PLA2G2A
SCHEMBL14739146 0.79 SYK (0.41) SYKKCNH2CYP2C9CYP2D6PLA2G2A
SCHEMBL14746803 0.78 SYK (0.40) SYKCYP2C9CYP2D6JAK2JAK1
SCHEMBL14737166 0.77 SYK (0.49) SYKKCNH2CYP2C9CYP2D6PLA2G2A
SCHEMBL14746730 0.76 SYK (0.39) SYKKCNH2CYP2C9CYP2D6
SCHEMBL14744201 0.75 SYK (0.64) SYKKCNH2CYP2C9CYP2D6JAK2

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-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US 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
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 1/4885KCNH2 3389/4885CYP2C9 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.