SCHEMBL4724497

SCHEMBL4724497

COc1cc(OC)c(Cl)c(NC(=O)OC(C)(C)C)c1C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.44
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LCK P06239 4/20 0.37
CYP3A4 P08684 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
USP2 O75604 1/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
SUV39H2 Q9H5I1 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL28184008 0.91 ATR (0.48) ATRALDH1A1GAAKDM4ELCK
SCHEMBL4792312 0.84 ATR (0.43) ATRALDH1A1GAAKDM4ELCK
SCHEMBL23888213 0.80 ATR (0.47) ATRALDH1A1GAAKDM4ELCK
SCHEMBL29869881 0.80 ATR (0.47) ATRALDH1A1GAAKDM4ELCK
SCHEMBL3606323 0.79 ALDH1A1 (0.42) ATRALDH1A1GAAKDM4ELCK
SCHEMBL145260 0.77 ALDH1A1 (0.51) ALDH1A1GAAKDM4EMEN1KMT2A
SCHEMBL2827128 0.77 ATR (0.41) ATRALDH1A1GAAKDM4ELCK
SCHEMBL29869783 0.76 ATR (0.46) ATRALDH1A1GAAKDM4ELCK
SCHEMBL23888253 0.76 ATR (0.46) ATRALDH1A1GAAKDM4ELCK
SCHEMBL4395627 0.76 ALDH1A1 (0.44) ATRALDH1A1GAAKDM4ELCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1976847-B1 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS NOVARTIS AG (CH) 2015-06-17 EP disclosed
US-8759517-B2 Pyrirnidinyl aryl urea derivatives being FGF inhibitors NOVARTIS AG (CH) 2014-06-24 US disclosed
US-20130030171-A1 Pyrimidinyl Aryl Urea Derivatives being FGF Inhibitors NOVARTIS AG (CH) 2013-01-31 US disclosed
US-8293746-B2 Pyrimidinyl aryl urea derivatives being FGF inhibitors NOVARTIS AG (CH) 2012-10-23 US disclosed
US-20080312248-A1 Pyrimidinyl Aryl Urea Derivatives Being Fgf Inhibitors NOVARTIS AG 2008-12-18 US disclosed
EP-1976847-A2 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS Novartis AG (CH) 2008-10-08 EP disclosed
WO-2007071752-A2 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS NOVARTIS AG (CH) 2007-06-28 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 (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-20080312248-A1 Pyrimidinyl Aryl Urea Derivatives Being Fgf Inhibitors FGFR1, FGF1, FGF2 ATR 2683/4885ALDH1A1 910/4885GAA 788/4885
US-20130030171-A1 Pyrimidinyl Aryl Urea Derivatives being FGF Inhibitors FGFR1, FGF1, FGF2 ATR 2683/4885ALDH1A1 910/4885GAA 788/4885

“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.