SCHEMBL3454584

SCHEMBL3454584

C#Cc1cccc(Nc2nccc(Nc3ccc4nc(C)oc4c3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.46
SYK P43405 1/20 0.46
KDR P35968 2/20 0.44
TERT O14746 1/20 0.44
DOT1L Q8TEK3 1/20 0.44
PDGFRB P09619 1/20 0.43
AURKA O14965 3/20 0.43
IDO1 P14902 2/20 0.43
TDO2 P48775 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
IGF1R P08069 2/20 0.42
CHEK1 O14757 1/20 0.42
IKBKB O14920 1/20 0.42
PDPK1 O15530 1/20 0.42
CHEK2 O96017 1/20 0.42
PRKCG P05129 1/20 0.42
CDK1 P06493 1/20 0.42
LYN P07948 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL14048172 0.84 SYK (0.67) EGFRSYKKDRTERTDOT1L
SCHEMBL4874466 0.82 EGFR (0.71) EGFRKDRNPC1RAB9AIGF1R
SCHEMBL4882518 0.76 SYK (0.50) EGFRSYKKDRAURKANPC1
SCHEMBL14770903 0.75 IGF1R (0.49) EGFRSYKKDRAURKANPC1
SCHEMBL3455225 0.74 ALDH1A1 (0.47) TERTDOT1LIGF1RMAPTMAPK1
SCHEMBL4872416 0.73 IGF1R (0.59) EGFRSYKKDRIGF1RCHEK1
SCHEMBL14024769 0.73 KDR (0.68) EGFRSYKKDRIGF1RCHEK1
SCHEMBL28285702 0.72 SYK (0.47) EGFRSYKKDRPDGFRBAURKA
SCHEMBL4882881 0.71 EGFR (0.41) EGFRSYKKDRPDGFRBIDO1
SCHEMBL24251899 0.70 ALDH1A1 (0.44) EGFRKDRPDGFRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8901143-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2014-12-02 US disclosed
US-8901143-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2014-12-02 US disclosed
US-8901143-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2014-12-02 US disclosed
EP-2154967-B9 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-07-23 EP disclosed
EP-2154967-B1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTPR LTD (BS) 2014-03-05 EP disclosed
US-20130065890-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED 2013-03-14 US disclosed
US-20130065890-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED 2013-03-14 US disclosed
US-20130065890-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED 2013-03-14 US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
US-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
EP-2154967-A1 PYRIMIDINE DERIVATIVES Hutchison Medipharma Enterprises Limited (BS) 2010-02-24 EP disclosed
WO-2008128231-A1 PYRIMIDINE DERIVATIVES HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2008-10-23 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-20130065890-A1 PYRIMIDINE DERIVATIVES TYMS, KDR, FLT4 EGFR 360/4885SYK 2737/4885KDR 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.