SCHEMBL6573311

SCHEMBL6573311

CCCc1c(N)ccc(O)c1CCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ESR1 P03372 2/20 0.40
AR P10275 1/20 0.38
ESR2 Q92731 1/20 0.38
PRKCI P41743 2/20 0.37
NOS2 P35228 1/20 0.37
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 2/20 0.36
ALOX15 P16050 2/20 0.36
GAA P10253 2/20 0.36
USP2 O75604 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
ACHE P22303 1/20 0.36
USP7 Q93009 1/20 0.36
HDAC3 O15379 1/20 0.35
IDO1 P14902 1/20 0.35
EP300 Q09472 1/20 0.35
KAT2B Q92831 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
SCHEMBL1760417 0.86 CNR1 (0.50) CNR1CNR2PRKCIHSD17B10ALDH1A1
SCHEMBL30027246 0.86 CNR1 (0.50) CNR1CNR2PRKCIHSD17B10ALDH1A1
SCHEMBL458150 0.86 NOS2 (0.45) ESR1NOS2HSD17B10ALDH1A1ALOX15
SCHEMBL9283660 0.86 TYR (0.47) ESR1HSD17B10ALDH1A1ALOX15HPGD
SCHEMBL28809895 0.85 CNR1 (0.39) CNR1CNR2ESR1ARESR2
SCHEMBL5082011 0.83 ALDH1A1 (0.35) ESR1ARESR2PRKCIHSD17B10
SCHEMBL14684826 0.81 TSHR (0.44) CNR1CNR2ESR1ESR2NOS2
SCHEMBL8672731 0.80 NOS2 (0.38) CNR1CNR2ESR1ARESR2
SCHEMBL27429680 0.77 TYR (0.47) ESR1HSD17B10ALDH1A1ALOX15ACHE
SCHEMBL6273700 0.77 ESR1 (0.40) ESR1ARESR2PRKCIHSD17B10

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920854-B1 Hair dye compositions containing 2,3 dialkyl-4-aminophenol and a 2-alkyl-1-naphthol. P & G CLAIROL INC (US) 2004-05-12 EP claimed
EP-0920854-A1 Hair dye compositions containing 2,3 dialkyl-4-aminophenol and A2-alkyl-1-naphthol. Bristol-Myers Squibb Company (US) 1999-06-09 EP claimed
US-5849042-A Hair dye compositions containing 2,3 dialkyl-4-aminophenol and a 2-alkyl-1-naphthol BRISTOL-MYERS SQUIBB (US) 1998-12-15 US claimed
EP-0920854-B1 Hair dye compositions containing 2,3 dialkyl-4-aminophenol and a 2-alkyl-1-naphthol. P & G CLAIROL INC (US) 2004-05-12 EP disclosed
CN-1115593-C Image forming process FUJI PHOTO FILM CO LTD (JP) 2003-07-23 CN disclosed
CN-1095677-C Compound (I) ZENECA LTD (GB) 2002-12-11 CN disclosed
EP-0920854-A1 Hair dye compositions containing 2,3 dialkyl-4-aminophenol and A2-alkyl-1-naphthol. Bristol-Myers Squibb Company (US) 1999-06-09 EP disclosed
US-5849042-A Hair dye compositions containing 2,3 dialkyl-4-aminophenol and a 2-alkyl-1-naphthol BRISTOL-MYERS SQUIBB (US) 1998-12-15 US disclosed
CN-1171054-A Compound (I) ZENECA LTD (GB) 1998-01-21 CN disclosed
CN-1155679-A Image forming process FUJI PHOTO FILM CO LTD (JP) 1997-07-30 CN disclosed