SCHEMBL22374875

SCHEMBL22374875

Nc1ncnc2occ(-c3ccc(NCNc4cc(C(F)(F)F)ccc4F)cc3)c12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TEK Q02763 11/20 0.71
RIPK1 Q13546 10/20 0.71
FLT1 P17948 10/20 0.71
CSF1R P07333 3/20 0.71
GSK3B P49841 3/20 0.71
FLT4 P35916 3/20 0.71
GSK3A P49840 2/20 0.71
CDK2 P24941 2/20 0.71
EGFR P00533 1/20 0.71
PDGFRB P09619 1/20 0.71
SRC P12931 1/20 0.71
PDGFRA P16234 1/20 0.71
AKT3 Q9Y243 1/20 0.71
KDR P35968 7/20 0.52
EPHB4 P54760 3/20 0.49
AURKA O14965 2/20 0.49
AURKB Q96GD4 2/20 0.49
KIT P10721 2/20 0.48
PLK4 O00444 2/20 0.48
MAPK13 O15264 2/20 0.48

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
Gw770249X SCHEMBL5652411 0.83 TEK (1.00) TEKRIPK1FLT1CSF1RGSK3B
Gw770249X SCHEMBL30957039 0.83 TEK (1.00) TEKRIPK1FLT1CSF1RGSK3B
Gw770249X SCHEMBL29638046 0.83 TEK (1.00) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL25008891 0.76 FLT1 (0.87) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL21085189 0.72 TEK (0.80) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL3524617 0.69 TEK (0.75) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL3113394 0.69 KDR (1.00) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL3120400 0.68 KDR (0.71) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL14013984 0.67 KDR (0.59) TEKRIPK1FLT1CSF1RGSK3B
SCHEMBL13708284 0.67 KDR (0.80) TEKRIPK1FLT1CSF1RGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200268897-A1 Phosphatase Binding Compounds and Methods of Using Same YALE UNIVERSITY 2020-08-27 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 (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-20200268897-A1 Phosphatase Binding Compounds and Methods of Using Same PPP5C, PPP4C, DUSP26 TEK 3467/4885RIPK1 360/4885FLT1 4347/4885

“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.