SCHEMBL4090690

SCHEMBL4090690

O=c1c(-c2ccccc2Cl)cc2cnc(NC3C4COCC3CN(Cc3ccccc3)C4)nc2n1C1CC1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.51
MAPK14 Q16539 1/20 0.51
TNK2 Q07912 4/20 0.43
ABL1 P00519 1/20 0.42
PAK1 Q13153 2/20 0.41
CCND1 P24385 8/20 0.40
CDK2 P24941 8/20 0.40
CCNE1 P24864 7/20 0.40
CDK6 Q00534 7/20 0.40
CDK4 P11802 3/20 0.40
PAK2 Q13177 1/20 0.40
SIK1 P57059 1/20 0.40
SIK2 Q9H0K1 1/20 0.40
SIK3 Q9Y2K2 1/20 0.40
CCNT1 O60563 1/20 0.40
CCND3 P30281 1/20 0.40
CDK9 P50750 1/20 0.40
FGFR1 P11362 2/20 0.40
CCNA2 P20248 1/20 0.39

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
SCHEMBL4084454 0.90 LCK (0.49) LCKMAPK14TNK2ABL1PAK1
SCHEMBL4090848 0.89 MAPK14 (0.63) LCKMAPK14ABL1FGFR1
SCHEMBL4091218 0.87 MAPK14 (0.46) LCKMAPK14TNK2ABL1PAK1
SCHEMBL4090415 0.84 MAPK14 (0.46) LCKMAPK14TNK2ABL1PAK1
SCHEMBL4094294 0.84 MAPK14 (0.64) LCKMAPK14ABL1PAK1FGFR1
SCHEMBL4084379 0.84 LCK (0.56) LCKMAPK14TNK2ABL1CCND1
SCHEMBL4094645 0.83 LCK (0.49) LCKMAPK14TNK2ABL1PAK1
SCHEMBL13849294 0.82 LCK (0.54) LCKMAPK14TNK2ABL1PAK1
SCHEMBL4088401 0.82 LCK (0.45) LCKMAPK14TNK2ABL1PAK1
SCHEMBL4084246 0.82 LCK (0.42) LCKMAPK14TNK2ABL1PAK1

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 8 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
EP-1831215-A1 PYRIDO[2,3-D]PYRIMIDINES AS ANTI-INFLAMATORY AGENTS Ranbaxy Laboratories Limited (IN) 2007-09-12 EP claimed
WO-2006056863-A1 PYRIDO’2, 3-D!PYRIMIDINES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-06-01 WO 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 3185/4885TNK2 1374/4885

“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.