SCHEMBL6170779

SCHEMBL6170779

Cc1cc(C)cc(CCCC(Nc2nc(N)nc(C(C)(C)F)n2)C2CC2)c1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
HRH4 Q9H3N8 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
SCHEMBL7785412 1.00 IDH1 (0.30) IDH1NOS3NOS1HRH4
SCHEMBL6303088 0.94 IDH1 (0.31) IDH1HRH4
SCHEMBL7785841 0.94 IDH1 (0.31) IDH1HRH4
SCHEMBL1551807 0.87 HTR7 (0.42) IDH1HRH4
SCHEMBL1552520 0.87 HTR7 (0.42) IDH1HRH4
SCHEMBL1551811 0.87 HTR7 (0.42) IDH1HRH4
SCHEMBL4004607 0.83 HTR7 (0.41) HRH4
SCHEMBL1551284 0.76 HTR7 (0.38) IDH1HRH4
SCHEMBL1552281 0.76 HTR7 (0.38) IDH1HRH4
SCHEMBL1551285 0.76 HTR7 (0.38) IDH1HRH4

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
EP-1087948-B1 2,4-DIAMINO-1,3,5-TRIAZINE, METHOD FOR THE PRODUCTION AND USE OF THE SAME AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2005-08-03 EP disclosed
US-6884758-B2 2,4-Diamino-1,3,5-triazines, their preparation, and their use as herbicides and plant growth regulators GOLDSCHMIDT AG (DE) 2005-04-26 US disclosed
US-20030162661-A1 2,4-Diamino-1,3,5-triazines, their preparation, and their use as herbicides and plant growth regulators BAYER CROPSCIENCE GMBH (DE) 2003-08-28 US disclosed
EP-1087948-A1 2,4-DIAMINO-1,3,5-TRIAZINE, METHOD FOR THE PRODUCTION AND USE OF THE SAME AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-04-04 EP disclosed
WO-1999065882-A1 2,4-DIAMINO-1,3,5-TRIAZINE, METHOD FOR THE PRODUCTION AND USE OF THE SAME AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 1999-12-23 WO 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-20030162661-A1 2,4-Diamino-1,3,5-triazines, their preparation, and their use as herbicides and plant growth regulators DDT, DAZAP1, DCUN1D5 IDH1 1055/4885NOS3 2597/4885NOS1 2617/4885

“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.