SCHEMBL4961598

SCHEMBL4961598

CO/N=C/c1c(N)ncnc1N1CCC(NC(=O)Nc2ccc(C3CCCCC3)cc2)CC1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 13/20 0.77
▸ KIT P10721 2/20 0.53
▸ PDGFRB P09619 1/20 0.53
▸ KDR P35968 3/20 0.51
▸ PAK1 Q13153 3/20 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
SCHEMBL4961607 1.00 FLT3 (0.77) FLT3KITPDGFRBKDRPAK1
SCHEMBL4959947 0.95 FLT3 (0.72) FLT3KITPDGFRBKDRPAK1
SCHEMBL4959932 0.95 FLT3 (0.72) FLT3KITPDGFRBKDRPAK1
SCHEMBL4962485 0.89 FLT3 (0.73) FLT3KITPDGFRBKDRPAK1
SCHEMBL4962489 0.89 FLT3 (0.73) FLT3KITPDGFRBKDRPAK1
SCHEMBL4963771 0.88 FLT3 (0.73) FLT3KITPDGFRBKDRPAK1
SCHEMBL4963760 0.88 FLT3 (0.73) FLT3KITPDGFRBKDRPAK1
SCHEMBL4961362 0.88 FLT3 (0.72) FLT3KITPDGFRBKDRPAK1
SCHEMBL4961375 0.88 FLT3 (0.72) FLT3KITPDGFRBKDRPAK1
SCHEMBL13956862 0.87 FLT3 (1.00) FLT3KITPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1896029-A1 AMINOPYRIMIDINES AS KINASE MODULATORS Janssen Pharmaceutica, N.V. (BE) 2008-03-12 — — EP disclosed
WO-2006135644-A1 AMINOPYRIMIDINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 — — WO disclosed
US-20060281764-A1 AMINOPYRIMIDINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-14 — — US disclosed
US-20060281700-A1 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOPYRIMIDINES KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-14 — — 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 (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-20060281764-A1 AMINOPYRIMIDINES AS KINASE MODULATORS FLT3, KIT, TYMP FLT3 1/4885KIT 2/4885PDGFRB 29/4885
US-20060281700-A1 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOPYRIMIDINES KINASE MODULATORS FLT3, TYMP, PHKG1 FLT3 1/4885KIT 127/4885PDGFRB 143/4885

“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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