SCHEMBL4084520

SCHEMBL4084520

O=c1c(-c2ccccc2Cl)cc2cnc(NC3CC4CCC(C3)N4Cc3ccccc3)nc2n1-c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.49
LCK P06239 1/20 0.49
ABL1 P00519 2/20 0.41
FGFR1 P11362 3/20 0.41
PAK1 Q13153 3/20 0.41
PAK2 Q13177 2/20 0.41
TNK2 Q07912 2/20 0.41
LYN P07948 1/20 0.40
BTK Q06187 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ROCK2 O75116 2/20 0.39
ARHGDIA P52565 2/20 0.39
ROCK1 Q13464 2/20 0.39
SIK1 P57059 1/20 0.39
SIK2 Q9H0K1 1/20 0.39
SIK3 Q9Y2K2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
EGFR P00533 1/20 0.38
PDGFRB P09619 1/20 0.38

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
SCHEMBL4089659 0.98 MAPK14 (0.49) MAPK14LCKABL1FGFR1PAK1
SCHEMBL13849294 0.86 LCK (0.54) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4097226 0.85 LCK (0.52) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4090983 0.85 MAPK14 (0.68) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4084207 0.84 MAPK14 (0.66) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4096767 0.83 MAPK14 (0.46) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4088404 0.83 MAPK14 (0.45) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4090415 0.81 MAPK14 (0.46) MAPK14LCKABL1FGFR1PAK1
SCHEMBL4084813 0.79 ROCK2 (0.48) MAPK14LCKFGFR1ROCK2ARHGDIA
SCHEMBL4083924 0.78 ABL1 (0.45) MAPK14LCKABL1FGFR1PAK1

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 MAPK14 3185/4885LCK 568/4885ABL1 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.