SCHEMBL3000079

SCHEMBL3000079

NCCNC(=O)[C@@H](N)Cc1c[nH]cn1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NLN Q9BYT8 3/20 0.37

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
SCHEMBL14151247 0.93 NLN (0.39) NLN
SCHEMBL8388715 0.92 GNAI3 (0.39) NLN
SCHEMBL8960512 0.89 NLN (0.37) NLN
SCHEMBL7624049 0.89 NLN (0.42) NLN
SCHEMBL7624042 0.89 NLN (0.42) NLN
SCHEMBL13080959 0.87 DPP7 (0.38) NLN
Hydrochloric Acid SCHEMBL30401731 0.87 NLN (0.36) NLN
Hydrochloric Acid SCHEMBL5263726 0.86 NLN (0.38) NLN
SCHEMBL9847297 0.86 MME (0.37) NLN
SCHEMBL18381248 0.86 MME (0.37) NLN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10822500-B2 Preparations as hydrophobing agents RUDOLF GMBH (DE) 2020-11-03 US disclosed
US-20190309174-A1 PREPARATION AS WATER REPELLING AGENTS RUDOLF GMBH (DE) 2019-10-10 US disclosed
US-8703894-B2 Fluorocarbon polymer-free preparations based on water and/or organic solvents and the use thereof as a finish on flat materials RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) 2014-04-22 US disclosed
US-20100190397-A1 FLUOROCARBON POLYMER-FREE PREPARATIONS BASED ON WATER AND/OR ORGANIC SOLVENTS AND THE USE THEREOF AS A FINISH ON FLAT MATERIALS RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) 2010-07-29 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-20100190397-A1 FLUOROCARBON POLYMER-FREE PREPARATIONS BASED ON WATER AND/OR ORGANIC SOLVENTS AND THE USE THEREOF AS A FINISH ON FLAT MATERIALS PIGS, FGB, F8 NLN 4715/4885

“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.