SCHEMBL21424869

SCHEMBL21424869

O=C=NCc1cccc(Cn2c(=O)n(Cc3cccc(CN=C=O)c3)c(=O)n(Cc3cccc(CN=C=O)c3)c2=O)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ RGS4 P49798 3/20 0.38
▸ RGS8 P57771 3/20 0.38
▸ C5AR1 P21730 1/20 0.38
▸ MIF P14174 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ PDE1B Q01064 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ ATM Q13315 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
SCHEMBL24587570 0.92 RGS4 (0.48) MAPTKDM4EHPGDLMNAGAA
SCHEMBL21452922 0.92 HPGD (0.41) MAPTKDM4EHPGDLMNAGAA
SCHEMBL21229703 0.91 MAPT (0.44) MAPTKDM4EHPGDLMNAGAA
SCHEMBL26785 0.85 MIF (0.47) HPGDLMNAMIFALDH1A1KMT2A
SCHEMBL5465655 0.85 MIF (0.47) HPGDLMNAMIFALDH1A1KMT2A
SCHEMBL22471928 0.83 MIF (0.46) HPGDLMNAMIFALDH1A1KMT2A
Water SCHEMBL14972890 0.83 MIF (0.46) KDM4EHPGDLMNAMIFALDH1A1
SCHEMBL28048374 0.83 MIF (0.46) HPGDLMNAMIFALDH1A1KMT2A
SCHEMBL25005513 0.82 RGS4 (0.37) MAPTKDM4EGAARGS4RGS8
SCHEMBL6437951 0.81 MIF (0.44) HPGDMIFALDH1A1KMT2AMEN1

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
US-20220033563-A1 POLYURETHANE-BASED COMPOSITION BOSTIK SA (FR) 2022-02-03 — — US disclosed
US-20210122869-A1 POLYURETHANE-BASED COMPOSITION BOSTIK SA (FR) 2021-04-29 — — US disclosed
US-20210032517-A1 POLYURETHANE-BASED COMPOSITION BOSTIK SA (FR) 2021-02-04 — — US disclosed
US-20200385509-A1 POLYURETHANE-BASED COMPOSITION BOSTIK SA (FR) 2020-12-10 — — US disclosed
US-20200238245-A1 A COMPOSITION COMPRISING SOLVENT AND HEAT RESISTANT CAPSULES AGFA-GEVAERT NV (BE) 2020-07-30 — — US disclosed
EP-3626472-A1 LASER MARKABLE COMPOSITIONS AGFA NV (BE) 2020-03-25 — — EP disclosed
US-20190300766-A1 ADHESIVE DUAL-COMPONENT COMPOSITION BASED ON POLYURETHANE BOSTIK SA (FR) 2019-10-03 — — US disclosed
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