SCHEMBL6729137

SCHEMBL6729137

CCc1ccccc1CNc1nc(O)nc(Nc2ccc3ncsc3c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.51
INSR P06213 3/20 0.51
PDGFRB P09619 3/20 0.51
PDGFRA P16234 3/20 0.51
TEK Q02763 3/20 0.51
CSF1R P07333 2/20 0.51
SYK P43405 1/20 0.46
IKBKB O14920 4/20 0.43
CHUK O15111 1/20 0.43
CFTR P13569 1/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
IRAK4 Q9NWZ3 2/20 0.41
TOP2A P11388 1/20 0.41
PFKFB3 Q16875 1/20 0.41
PRKD1 Q15139 1/20 0.41
PLK1 P53350 1/20 0.41

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
SCHEMBL6406493 0.88 KDR (0.51) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6400459 0.88 PFKFB3 (0.52) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6315627 0.85 KDR (0.64) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6395906 0.82 KDR (0.60) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6314646 0.81 AURKA (0.54) SYKMEN1NPC1RAB9AKMT2A
SCHEMBL6730170 0.81 KCNH3 (0.53) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6403872 0.80 JAK3 (0.50) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6313972 0.80 KDR (0.46) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6405264 0.80 KDR (0.53) KDRINSRPDGFRBPDGFRATEK
SCHEMBL6400760 0.80 KDR (0.47) KDRINSRPDGFRBPDGFRATEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822105-B2 Diaminotriazine compounds as herbicides BASF SE (DE) 2017-11-21 US disclosed
EP-3134400-A1 DIAMINOTRIAZINE COMPOUNDS AS HERBICIDES BASF SE (DE) 2017-03-01 EP disclosed
US-20170050954-A1 Diaminotriazine Compounds as Herbicides BASF SE (DE) 2017-02-23 US disclosed
WO-2015162169-A1 DIAMINOTRIAZINE COMPOUNDS AS HERBICIDES BASF SE (DE) 2015-10-29 WO disclosed
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 (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-20040110758-A1 4,6-Diaminosubstituted-2-[oxy or aminoxy]-[1,3,5]triazines as protein tyrosine kinase inhibitors TIE1, KDR, FLT1 KDR 2/4885INSR 358/4885PDGFRB 28/4885
US-20170050954-A1 Diaminotriazine Compounds as Herbicides NR4A3, RXRB, CBR3 KDR 936/4885INSR 835/4885PDGFRB 1566/4885

“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.