SCHEMBL6572090

SCHEMBL6572090

COCCN(CCOC)c1ccc(N)cc1-c1ccc(N)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 6/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 2/20 0.31
MAPK1 P28482 2/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
PSMD14 O00487 1/20 0.31
RECQL P46063 1/20 0.31
GFER P55789 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
DHFR P00374 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL6571013 0.93 CRHR1 (0.38) CRHR1MEN1KMT2ATSHRMAPT
SCHEMBL6572104 0.91 CRHR1 (0.32) CRHR1
SCHEMBL6574108 0.91 CRHR1 (0.33) CRHR1MEN1KMT2AMAPK1MAPT
SCHEMBL6572015 0.91 TDP1 (0.41) CRHR1MAPK1GAAMAPTALDH1A1
SCHEMBL6571975 0.91 GRM2 (0.38) CRHR1ALDH1A1
SCHEMBL6571986 0.91 MEN1 (0.41) CRHR1MEN1KMT2ACYP3A4
SCHEMBL6572455 0.91 USP7 (0.35) CRHR1MEN1KMT2AGAAMAPT
SCHEMBL6572183 0.90 FYN (0.36) CRHR1MEN1KMT2AALDH1A1PTGDR2
SCHEMBL6574909 0.90 ALDH1A1 (0.40) CRHR1MEN1KMT2ATSHRMAPK1
SCHEMBL6573595 0.89 CRHR1 (0.34) CRHR1TSHRMAPK1GAAMAPT

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