SCHEMBL6724072

SCHEMBL6724072

Oc1nc(Nc2ccc3ncsc3c2)nc(N(CCN2CCNCC2)Cc2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.49
INSR P06213 4/20 0.49
TEK Q02763 4/20 0.49
PDGFRB P09619 3/20 0.49
PDGFRA P16234 3/20 0.49
CSF1R P07333 2/20 0.49
CFTR P13569 1/20 0.42
IKBKB O14920 8/20 0.41
CHUK O15111 5/20 0.41
SYK P43405 1/20 0.38
UBE2M P61081 1/20 0.37
DCUN1D1 Q96GG9 1/20 0.37
TOP2A P11388 1/20 0.35

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
SCHEMBL6401975 0.90 KDR (0.47) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6401060 0.88 KDR (0.48) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6394323 0.87 KDR (0.47) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6313981 0.86 KDR (0.45) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6729223 0.84 KDR (0.57) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6404350 0.84 KDR (0.54) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6399454 0.83 KDR (0.65) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6728908 0.83 KDR (0.54) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6394106 0.82 KDR (0.52) KDRINSRTEKPDGFRBPDGFRA
SCHEMBL6392117 0.81 KDR (0.47) KDRINSRTEKPDGFRBPDGFRA

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-20040110758-A1 4,6-Diaminosubstituted-2-[oxy or aminoxy]-[1,3,5]triazines as protein tyrosine kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2004-06-10 US claimed
US-20040110758-A1 4,6-Diaminosubstituted-2-[oxy or aminoxy]-[1,3,5]triazines as protein tyrosine kinase inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2004-06-10 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-20040110758-A1 4,6-Diaminosubstituted-2-[oxy or aminoxy]-[1,3,5]triazines as protein tyrosine kinase inhibitors TIE1, KDR, FLT1 KDR 2/4885INSR 358/4885TEK 5/4885

“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.