SCHEMBL4087492

SCHEMBL4087492

O=CNc1nc(NC=O)nc(NC=O)n1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL14543886 0.86 CA12 (0.31)
SCHEMBL28884749 0.79 ALDH1A1 (0.35) ALDH1A1
Water SCHEMBL9507408 0.78 CA1 (0.33)
Formaldehyde SCHEMBL3043572 0.76 CA1 (0.32)
Hydroxyamine SCHEMBL11315924 0.76 CA1 (0.32)
SCHEMBL10996792 0.76 ALDH1A1 (0.49) ALDH1A1
SCHEMBL4640674 0.76 MAPT (0.34) ALDH1A1
SCHEMBL11853374 0.76 S1PR2 (0.35) ALDH1A1
SCHEMBL6791945 0.74 MEN1 (0.33)
SCHEMBL8351928 0.74 MAPT (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113429361-B Preparation method of tris (N-1, 4-dimethylpentyl p-phenylenediamine) -1,3, 5-triazine and intermediate thereof 山东阳谷华泰化工股份有限公司 2022-08-26 CN claimed
CN-113563276-B Preparation method of anti-aging agent TAPDT and intermediate thereof 山东阳谷华泰化工股份有限公司 2024-04-09 CN disclosed
CN-113429361-B Preparation method of tris (N-1, 4-dimethylpentyl p-phenylenediamine) -1,3, 5-triazine and intermediate thereof 山东阳谷华泰化工股份有限公司 2022-08-26 CN disclosed
US-7507818-B2 Method for the production of alkoxycarbonylaminotriazines BASF AKTIENGESELLSCHAFT (DE) 2009-03-24 US disclosed
US-20060069254-A1 Method for the production of alkoxycarbonylamino triazines BASF AKTIENGESELLSCHAFT (DE) 2006-03-30 US disclosed
US-5086172-A Reacting 2,4,6-trihalogeno-1,3,5-triazine with alkali or alkaline earth metal cyanide BAYER AKTIENGESELLSCHAFT (DE) 1992-02-04 US disclosed
EP-0436915-A2 Process for the preparation of 2,4,6-tricyano-1,3,5-triazine BAYER AG (DE) 1991-07-17 EP 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-20060069254-A1 Method for the production of alkoxycarbonylamino triazines ADH1C, ADH5, ADH1A ALDH1A1 211/4885

“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.