SCHEMBL1707661

SCHEMBL1707661

COc1ccc(OCCO)cc1Nc1ncc(F)c(Nc2cccc(C)c2NS(C)(=O)=O)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 7/20 0.49
▸ GLO1 Q04760 3/20 0.46
▸ GSK3A P49840 1/20 0.46
▸ LRRK2 Q5S007 1/20 0.46
▸ MAPK15 Q8TD08 1/20 0.46
▸ CAMKK2 Q96RR4 1/20 0.46
▸ EGFR P00533 4/20 0.44
▸ AURKA O14965 1/20 0.43
▸ ITK Q08881 1/20 0.43
▸ ALK Q9UM73 2/20 0.43
▸ IGF1R P08069 1/20 0.42
▸ MAPK8 P45983 1/20 0.42
▸ ROS1 P08922 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
SCHEMBL1707148 0.91 EGFR (0.54) LRRK2EGFRALKROS1
SCHEMBL1707467 0.89 GLO1 (0.58) SYKGLO1GSK3ALRRK2MAPK15
SCHEMBL1707873 0.87 EGFR (0.54) EGFRALKROS1
SCHEMBL1707581 0.86 GSK3A (0.51) SYKGLO1GSK3ALRRK2MAPK15
SCHEMBL1706923 0.84 EGFR (0.55) EGFRALKROS1
SCHEMBL1038935 0.80 SYK (0.68) SYKGLO1EGFRITK
SCHEMBL1039621 0.80 SYK (0.56) SYKGLO1GSK3ALRRK2MAPK15
SCHEMBL1037179 0.79 SYK (0.56) SYKGLO1EGFRAURKAITK
SCHEMBL1707766 0.79 EGFR (0.61) LRRK2EGFRALKROS1
SCHEMBL1708502 0.79 GLO1 (0.65) GLO1GSK3ALRRK2MAPK15CAMKK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 — — US claimed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 — — EP claimed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 — — WO claimed
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 — — US disclosed
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 — — US disclosed
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 — — US disclosed
EP-2440534-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS Cellzome Limited (GB) 2012-04-18 — — EP disclosed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 — — WO disclosed
WO-2010142766-A2 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2010-12-16 — — 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-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS ZAP70, LCK, DPY30 SYK 11/4885GLO1 4299/4885GSK3A 1621/4885

“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.

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