SCHEMBL5770003

SCHEMBL5770003

COc1ccc(N2Cc3cnc(Nc4ccccc4)nc3N(C3CCCCC3)C2=O)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 10/20 0.79
EGFR P00533 9/20 0.79
FGFR1 P11362 5/20 0.79
FGFR2 P21802 5/20 0.79
FGFR3 P22607 5/20 0.79
PDGFRB P09619 3/20 0.79
PDGFRA P16234 3/20 0.79
KDR P35968 3/20 0.79
FYN P06241 2/20 0.79
MAPK1 P28482 2/20 0.79
EPHB3 P54753 2/20 0.79
PRKACA P17612 1/20 0.66
PRKACG P22612 1/20 0.66
PRKACB P22694 1/20 0.66
MARK3 P27448 2/20 0.53
MARK4 Q96L34 1/20 0.53
CSF1R P07333 1/20 0.52
MAPK9 P45984 1/20 0.52
USP2 O75604 1/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL5768936 0.99 FGFR4 (0.80) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5767242 0.91 EGFR (0.76) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5770073 0.91 EGFR (0.76) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5831546 0.91 EGFR (0.90) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5767065 0.91 EGFR (0.90) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5745949 0.90 EGFR (0.72) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5767331 0.90 EGFR (0.72) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5767330 0.89 EGFR (0.73) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5811223 0.88 EGFR (1.00) FGFR4EGFRFGFR1FGFR2FGFR3
SCHEMBL5772112 0.88 EGFR (0.74) FGFR4EGFRFGFR1FGFR2FGFR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115740-B2 Pyrimido compounds having antiproliferative activity HOFFMANN-LA ROCHE INC. (US) 2006-10-03 US claimed
EP-1615928-A1 PYRIMIDO COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2006-01-18 EP claimed
WO-2004089955-A1 PYRIMIDO COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2004-10-21 WO claimed
US-20040204427-A1 Pyrimido compounds having antiproliferative activity CHEN YI (US) 2004-10-14 US claimed
US-20080125362-A1 Method of screening compound preventing cells from infection with Hepatitis C virus (HCV) JAPAN TOBACCO INC. (JP) 2008-05-29 US disclosed
US-20080125362-A1 Method of screening compound preventing cells from infection with Hepatitis C virus (HCV) JAPAN TOBACCO INC. (JP) 2008-05-29 US disclosed
US-7115740-B2 Pyrimido compounds having antiproliferative activity HOFFMANN-LA ROCHE INC. (US) 2006-10-03 US disclosed
EP-1615928-A1 PYRIMIDO COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2006-01-18 EP disclosed
WO-2004089955-A1 PYRIMIDO COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2004-10-21 WO disclosed
US-20040204427-A1 Pyrimido compounds having antiproliferative activity CHEN YI (US) 2004-10-14 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 (2 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-20040204427-A1 Pyrimido compounds having antiproliferative activity FGFR3, FGFR1, FGFR4 FGFR4 3/4885EGFR 41/4885FGFR1 2/4885
US-20080125362-A1 Method of screening compound preventing cells from infection with Hepatitis C virus (HCV) HAVCR2, FGFR1, FGFR2 FGFR4 5/4885EGFR 55/4885FGFR1 2/4885

“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.