SCHEMBL6572154

SCHEMBL6572154

COCCN(CCOC)c1ccc(N)cc1-c1cc(Cl)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RECQL P46063 1/20 0.43
CRHR1 P34998 4/20 0.43
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 1/20 0.40
LRRK2 Q5S007 1/20 0.39
AGPAT2 O15120 8/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL6570737 0.88 MEN1 (0.47) MEN1LMNAKMT2AL3MBTL1RECQL
SCHEMBL6570817 0.86 HDAC4 (0.39) MEN1KMT2ACRHR1ALDH1A1GAA
SCHEMBL6571582 0.85 GAA (0.40) LMNACRHR1ALDH1A1KDM4EGAA
SCHEMBL6572937 0.85 CRHR1 (0.54) CRHR1
SCHEMBL6573046 0.83 HTR7 (0.44) LMNACRHR1ALDH1A1GAAMAPT
SCHEMBL6574535 0.82 FDPS (0.43) LMNAL3MBTL1ALDH1A1MAPTHTT
SCHEMBL6571986 0.82 MEN1 (0.41) MEN1KMT2ACRHR1
SCHEMBL6572453 0.81 HDAC4 (0.37) LMNACRHR1ALDH1A1KDM4EGAA
SCHEMBL6573371 0.79 CRHR1 (0.41) MEN1KMT2ACRHR1
SCHEMBL6572169 0.79 DYRK1A (0.41) MEN1LMNAKMT2AL3MBTL1CRHR1

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
EP-1051143-B1 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AG (DE) 2004-07-21 EP claimed
EP-1051143-B1 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AG (DE) 2004-07-21 EP disclosed
US-6500213-B1 Oxidizing hair coloring agents containing 2,5-diamino-1-phenylbenzene derivatives and novel 2,5-diamino-1-phenylbenzene derivatives WELLA AKTIENGESELLSCHAFT (DE) 2002-12-31 US disclosed
EP-1051143-A2 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES Wella Aktiengesellschaft (DE) 2000-11-15 EP disclosed
WO-1999059527-A2 OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 1999-11-25 WO disclosed