SCHEMBL6517890

SCHEMBL6517890

C=CCOC(=O)NCC(C)c1ccc(-c2nc(Nc3ccc(CCO)cc3)ncc2Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 17/20 0.54
KDR P35968 17/20 0.54
JAK2 O60674 2/20 0.37
FLT3 P36888 2/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
ABL1 P00519 1/20 0.36
PDGFRB P09619 1/20 0.36
SRC P12931 1/20 0.36
PDGFRA P16234 1/20 0.36
MAPK14 Q16539 1/20 0.36

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
SCHEMBL6888387 0.88 CDK1 (0.47) CDK1KDR
SCHEMBL6511553 0.88 EGFR (0.41) CDK1KDRJAK2FLT3JAK1
SCHEMBL6519463 0.87 CDK1 (0.58) CDK1KDRJAK2JAK1JAK3
SCHEMBL6509043 0.86 CDK1 (0.61) CDK1KDRJAK2FLT3ABL1
SCHEMBL6517883 0.82 CDK1 (0.65) CDK1KDRABL1PDGFRBSRC
SCHEMBL6510348 0.77 EGFR (0.40) CDK1KDR
SCHEMBL6888385 0.77 CDK1 (0.53) CDK1KDR
SCHEMBL6512138 0.76 CDK1 (0.37) CDK1KDR
SCHEMBL6034496 0.75 KDR (0.62) CDK1KDR
SCHEMBL6511549 0.71 CDK1 (0.49) CDK1KDR

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-20050171134-A1 4,5-Disubstituted-2-aminopyrimidines CELLTECH R&D LIMITED 2005-08-04 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-20050171134-A1 4,5-Disubstituted-2-aminopyrimidines FLT1, FLT4, FGFR1 CDK1 435/4885KDR 8/4885JAK2 258/4885

“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.