SCHEMBL1879780

SCHEMBL1879780

CCn1c(=O)c(-c2cc(C(=O)Nc3ccon3)cc(F)c2C)nc2cnn(-c3ccc(F)cc3F)c21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.47
CYP3A4 P08684 1/20 0.47
LCK P06239 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KIT P10721 1/20 0.39
KDR P35968 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
KDM4E B2RXH2 1/20 0.35
CNR1 P21554 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
CNR2 P34972 1/20 0.33

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
SCHEMBL1880731 0.90 MAPK14 (0.51) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL1883729 0.84 MAPK14 (0.50) MAPK14CYP3A4LCKKITKDR
SCHEMBL1883542 0.84 MAPK14 (0.66) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL1880113 0.80 MAPK14 (0.67) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL1880870 0.79 MAPK14 (0.65) MAPK14LCKCYP2C9CYP2C19KIT
SCHEMBL13692227 0.78 MAPK14 (0.36) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL12671933 0.75 MAPK14 (0.39) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL3667389 0.74 MAPK14 (0.79) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL1879539 0.73 MAPK14 (0.65) MAPK14CYP3A4LCKCYP2C9CYP2C19
SCHEMBL1886774 0.73 MAPK14 (0.66) MAPK14CYP3A4LCKCYP2C9KIT

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-8367671-B2 Pyrazolo[3.4-B]pyrazine compounds as p38 modulators and methods of use as anti-inflamatory agents AMGEN INC. (US) 2013-02-05 US disclosed
US-8367671-B2 Pyrazolo[3.4-B]pyrazine compounds as p38 modulators and methods of use as anti-inflamatory agents AMGEN INC. (US) 2013-02-05 US disclosed
US-20110105499-A1 Pyrazolo-Pyrazinone Compounds and Methods of Use Thereof AMGEN INC. (US) 2011-05-05 US disclosed
WO-2009117156-A1 PYRAZOLO-PYRAZINONE COMPOUNDS AND METHODS OF USE THEREOF AMGEN INC. (US) 2009-09-24 WO 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-20110105499-A1 Pyrazolo-Pyrazinone Compounds and Methods of Use Thereof MAPK1, MAP3K1, MAP4K2 MAPK14 32/4885CYP3A4 1121/4885LCK 461/4885

“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.