SCHEMBL6128205

SCHEMBL6128205

Cc1cc(=O)[nH]c(NC(=O)NCCCCCCN)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
PKM P14618 1/20 0.49
NPC1 O15118 2/20 0.48
GAA P10253 2/20 0.48
USP2 O75604 2/20 0.43
MAPK1 P28482 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 1/20 0.43
ALOX15 P16050 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.40
GPR84 Q9NQS5 2/20 0.40
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
NCOA1 Q15788 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39

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
SCHEMBL522870 0.82 PAOX (0.39) ALDH1A1PAOXHTT
SCHEMBL15978635 0.82 PAOX (0.39) ALDH1A1PAOXHTT
SCHEMBL29087967 0.82 POLB (0.44) POLBPKMNPC1GAAUSP2
SCHEMBL27047920 0.81 PAOX (0.38) ALDH1A1PAOXHTT
SCHEMBL1569353 0.81 PAOX (0.36) SMN1; SMN2KDM4EPAOXHTT
Hydrochloric Acid SCHEMBL27090099 0.81 PAOX (0.37) ALDH1A1PAOXHTT
Hydrochloric Acid SCHEMBL14486716 0.80 PAOX (0.36) NPC1SMN1; SMN2KDM4EPAOX
SCHEMBL19820836 0.80 POLB (0.54) POLBPKMNPC1GAAUSP2
SCHEMBL31119185 0.80 POLB (0.46) POLBPKMNPC1GAAUSP2
SCHEMBL12193377 0.77 EPHX1 (0.38) ALDH1A1PAOXHTT

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
WO-2012156610-A1 USE OF A SUPRAMOLECULAR POLYMER FOR THE MANUFACTURE OF A FIRE-RESISTANT MATERIAL ARKEMA FRANCE (FR) 2012-11-22 WO claimed
WO-2018037194-A1 EPOXY ADDUCT BEARING BINDING GROUPS, PRODUCTION METHOD THEREOF AND USES OF SAME ARKEMA FRANCE (FR) 2018-03-01 WO disclosed
WO-2018037195-A1 BLOCK COPOLYMER BEARING BINDING GROUPS, PRODUCTION METHOD THEREOF AND USES OF SAME ARKEMA FRANCE (FR) 2018-03-01 WO disclosed
WO-2012156610-A1 USE OF A SUPRAMOLECULAR POLYMER FOR THE MANUFACTURE OF A FIRE-RESISTANT MATERIAL ARKEMA FRANCE (FR) 2012-11-22 WO disclosed
WO-2012066244-A1 MASTERBATCH OF CARBON NANOTUBES AND CURING AGENT FOR THERMOSETTING RESINS ARKEMA FRANCE (FR) 2012-05-24 WO disclosed