SCHEMBL4090416

SCHEMBL4090416

Cn1c(=O)c(-c2ccccc2Cl)cc2cnc(NC3C4CN(CCC#N)CC43)nc21

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.59
MAPK14 Q16539 1/20 0.59
ABL1 P00519 1/20 0.52
RIPK2 O43353 3/20 0.51
NOD2 Q9HC29 3/20 0.51
ACVR1 Q04771 2/20 0.51
FGFR1 P11362 11/20 0.50
PAK1 Q13153 1/20 0.48
SIK1 P57059 1/20 0.47
SIK2 Q9H0K1 1/20 0.47
SIK3 Q9Y2K2 1/20 0.47
EGFR P00533 5/20 0.47
SRC P12931 3/20 0.47
FGFR2 P21802 2/20 0.47
FGFR4 P22455 2/20 0.47
FGFR3 P22607 2/20 0.47
WEE1 P30291 2/20 0.47
TNK2 Q07912 1/20 0.45

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
SCHEMBL4089831 0.89 LCK (0.49) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4084253 0.87 MAPK14 (0.62) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4091035 0.85 MAPK14 (0.62) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4089655 0.84 LCK (0.63) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4101345 0.82 MAPK14 (0.63) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4084178 0.82 MAPK14 (0.63) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4084289 0.82 LCK (0.60) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL4094886 0.82 LCK (0.67) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL13849305 0.81 PAK1 (0.47) LCKMAPK14ABL1RIPK2NOD2
SCHEMBL13849317 0.81 LCK (0.59) LCKMAPK14ABL1RIPK2NOD2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131430-A1 PYRIDO'2,3-DIPYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-05-21 US claimed
US-20090131430-A1 PYRIDO'2,3-DIPYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-05-21 US disclosed
US-20090131430-A1 PYRIDO'2,3-DIPYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-05-21 US disclosed
US-20090131430-A1 PYRIDO'2,3-DIPYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2009-05-21 US disclosed
EP-1831215-A1 PYRIDO[2,3-D]PYRIMIDINES AS ANTI-INFLAMATORY AGENTS Ranbaxy Laboratories Limited (IN) 2007-09-12 EP disclosed
WO-2006056863-A1 PYRIDO’2, 3-D!PYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-06-01 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-20090131430-A1 PYRIDO'2,3-DIPYRIMIDINES AS ANTI-INFLAMMATORY AGENTS TLR1, TPMT, NOD1 LCK 568/4885MAPK14 3185/4885ABL1 3439/4885

“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.