SCHEMBL5843166

SCHEMBL5843166

CCc1nc(-c2cc3nccc(Oc4ccc5[nH]c(C)cc5c4)c3s2)sc1[N+]1(C)CCN(C=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 8/20 0.35
EGFR P00533 7/20 0.35
KDR P35968 5/20 0.32
RET P07949 1/20 0.31
MET P08581 1/20 0.30

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
SCHEMBL5839258 0.74 HRH4 (0.42) FLT1EGFRKDR
SCHEMBL5838512 0.71 MET (0.48) FLT1EGFRKDRRETMET
SCHEMBL5838845 0.69 FLT1 (0.36) FLT1EGFRKDRRETMET
SCHEMBL5838087 0.69 FLT1 (0.36) FLT1EGFRKDRRETMET
SCHEMBL6677050 0.68 KDR (0.53) FLT1KDR
SCHEMBL6667981 0.67 KDR (0.54) FLT1KDRMET
SCHEMBL5837741 0.66 KDR (0.42) FLT1KDR
SCHEMBL5837748 0.66 KDR (0.42) FLT1KDR
SCHEMBL5838588 0.66 KDR (0.42) FLT1KDR
SCHEMBL5838689 0.65 KDR (0.46) FLT1KDRMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6995171-B2 Bicyclic pyrimidine and pyrimidine derivatives useful as anticancer agents AGOURON PHARMACEUTICALS, INC. (US) 2006-02-07 US claimed
US-20040171590-A1 Bicyclic pyrimidine and pyrimidine derivatives useful as anticancer agents AUTRY CHRISTOPHER (US) 2004-09-02 US claimed

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-20040171590-A1 Bicyclic pyrimidine and pyrimidine derivatives useful as anticancer agents TK1, TYMP, DPYD FLT1 606/4885EGFR 1625/4885KDR 1886/4885

“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.