SCHEMBL6571056

SCHEMBL6571056

COCCN(CCOC)c1ccc(N)c(-c2ccc(O)cc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 4/20 0.36
GAA P10253 4/20 0.36
SI P14410 4/20 0.36
MGAM2 Q2M2H8 4/20 0.36
USP7 Q93009 4/20 0.35
F2 P00734 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
ESR2 Q92731 1/20 0.34
ABL1 P00519 2/20 0.34
ABCB1 P08183 2/20 0.34
BCR P11274 2/20 0.34
S100B P04271 1/20 0.33
FYN P06241 3/20 0.33
CHEK2 O96017 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM2 Q14416 1/20 0.31
RELA Q04206 1/20 0.31

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
SCHEMBL6572336 0.89 S100B (0.33) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6571429 0.89 ALDH1A1 (0.36) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6571926 0.88 F2 (0.38) GAAF2PRSS1PRSS2PRSS3
SCHEMBL6572008 0.87 MAPT (0.35) MGAMGAASIMGAM2F2
SCHEMBL6570859 0.87 S100B (0.37) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6570799 0.87 GRM2 (0.38) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6571984 0.86 S100B (0.36) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6572323 0.86 ALOX15 (0.40) ABL1ABCB1BCRKMT2ARELA
SCHEMBL6574728 0.86 KMT2A (0.41) F2PRSS1PRSS2PRSS3S100B
SCHEMBL6572478 0.86 S100B (0.33) F2PRSS1PRSS2PRSS3S100B

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