SCHEMBL419949

SCHEMBL419949

NC(=O)Nc1ccn[c]n1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 15/20 0.37
PEPD P12955 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
GFER P55789 1/20 0.32

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
SCHEMBL15415971 0.73 RAB9A (0.43) NPC1ALDH1A1MEN1KMT2AMAPT
SCHEMBL513745 0.71 NR3C2 (0.38) NR3C2PEPDNPC1ALDH1A1MEN1
SCHEMBL1855579 0.69
SCHEMBL5262945 0.67 CHRNB2 (0.50) NR3C2NPC1
SCHEMBL10399713 0.67 NR3C2 (0.45) NR3C2ALDH1A1GAAMAPT
SCHEMBL10622224 0.67 GOT1 (0.55) NR3C2NPC1
SCHEMBL31579540 0.67 CHRNB2 (0.50) NR3C2NPC1
SCHEMBL9625171 0.65 PEPD (0.44) PEPDNPC1ALDH1A1MEN1KMT2A
SCHEMBL4989868 0.65 KEAP1 (0.36) ALDH1A1
SCHEMBL9413728 0.64 MEN1 (0.55) NR3C2ALDH1A1MEN1KMT2AGAA

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 164 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024134093-A1 ELASTOMER COMPOSITIONS COMPRISING A PYROLYSIS CARBON BLACK COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-06-27 WO claimed
WO-2024133251-A1 ELASTOMERIC COMPOSITIONS COMPRISING A SILICON-TREATED CARBON BLACK COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2024-06-27 WO claimed
US-11827778-B2 Ink based on fluorinated polymer having improved adhesion ARKEMA FRANCE (FR) 2023-11-28 US claimed
US-20220403056-A1 CURED RUBBER NETWORK WITH COVALENT AND HYDROGEN-BONDED CROSSLINKS BRIDGESTONE CORPORATION (JP) 2022-12-22 US claimed
EP-4058487-A2 CURED RUBBER NETWORK WITH COVALENT AND HYDROGEN-BONDED CROSSLINKS BRIDGESTONE CORPORATION (JP) 2022-09-21 EP claimed
WO-2021097455-A2 CURED RUBBER NETWORK WITH COVALENT AND HYDROGEN-BONDED CROSSLINKS BRIDGESTONE CORPORATION (JP) 2021-05-20 WO claimed
EP-3774390-A1 TYRE INCLUDING A RUBBER COMPOSITION COMPRISING A NOVEL POLYSULPHIDE COUPLING AGENT HAVING NITROGENOUS ASSOCIATIVE GROUPS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-02-17 EP claimed
EP-3774389-A1 TYRE COMPRISING A RUBBER COMPOSITION COMPRISING A NOVEL POLYSULPHIDE COUPLING AGENT BEARING NITROGEN-CONTAINING ASSOCIATIVE GROUPS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 2021-02-17 EP claimed
US-20200207970-A1 INK BASED ON FLUORINATED POLYMER HAVING IMPROVED ADHESION ARKEMA FRANCE (FR) 2020-07-02 US claimed
EP-3638732-A1 FLUORINATED POLYMER-BASED COMPOSITION HAVING IMPROVED ADHESION Arkema France (FR) 2020-04-22 EP claimed
US-20120022221-A1 Use, as a Shock Absorber, of a Material Formed from Branched Molecules Containing Associative Groups ARKEMA FRANCE 2012-01-26 US claimed
US-20110245421-A1 METHOD FOR INCREASING POLYMER COMPATIBILITY ARKEMA FRANCE 2011-10-06 US claimed
US-20110183098-A1 NOVEL ELASTOMER MATERIAL, AND METHOD FOR OBTAINING SAME ARKEMA FRANCE (FR) 2011-07-28 US claimed
US-20110166293-A1 COMPOSITION CONTAINING (METH)ACRYLIC POLYMER AND COPOLYMER HAVING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2011-07-07 US claimed
US-20110077342-A1 METHOD FOR THE MULTI-STEP PREPARATION OF HALOGEN-CONTAINING COMPOSITE LATEX HAVING ASSOCIATIVE GROUPS ARKEMA FRANCE 2011-03-31 US claimed
US-20110065860-A1 METHOD FOR PREPARING A BLEND OF HALOGENATED POLYMER AND OF COPOLYMER BEARING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2011-03-17 US claimed
US-20110065866-A1 Composition containing a halogenated vinyl polymer and a copolymer bearing associative groups ARKEMA FRANCE (FR) 2011-03-17 US claimed
US-20110003872-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2011-01-06 US claimed
EP-2217641-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2010-08-18 EP claimed
WO-2009071554-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS ARKEMA FRANCE (FR) 2009-06-11 WO claimed

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-20110003872-A1 MATERIAL FORMED FROM DENDRITIC MOLECULES CONTAINING ASSOCIATIVE GROUPS HLA-DRB1, CD14, CD74 NR3C2 4753/4885PEPD 2389/4885NPC1 3489/4885

“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.