SCHEMBL249793

SCHEMBL249793

Cc1ccc2ccccc2c1-c1ccccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.48
CYP2A6 P11509 2/20 0.48
TSHR P16473 2/20 0.48
NSD2 O96028 1/20 0.46
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
HKDC1 Q2TB90 1/20 0.46
PTPN22 Q9Y2R2 1/20 0.44
HSD11B1 P28845 1/20 0.43
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
DNMT1 P26358 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP2C19 P33261 3/20 0.41

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
SCHEMBL2703913 0.83 THRB (0.50) CYP1A2CYP2A6TSHRNSD2OPRM1
SCHEMBL8668537 0.83 HSP90AA1 (0.48) CYP1A2CYP2A6TSHRNSD2OPRM1
SCHEMBL7915042 0.82 DHFR (0.54) CYP1A2CYP2A6TSHRHSD11B1ALDH1A1
SCHEMBL6403846 0.82 NSD2 (0.54) CYP1A2NSD2OPRM1OPRD1HKDC1
SCHEMBL2557210 0.82 CYP2A6 (0.54) CYP1A2CYP2A6TSHRNSD2OPRM1
SCHEMBL28898204 0.82 ALDH1A1 (0.48) CYP1A2TSHRALDH1A1MAPTKDM4E
SCHEMBL5025765 0.81 CYP1A2 (0.52) CYP1A2CYP2A6TSHRNSD2OPRM1
SCHEMBL2951616 0.80 TSHR (0.65) CYP1A2CYP2A6TSHRHSD11B1ALDH1A1
SCHEMBL29352216 0.80 TSHR (0.65) CYP1A2CYP2A6TSHRHSD11B1ALDH1A1
SCHEMBL8509086 0.79 TSHR (0.54) CYP1A2CYP2A6TSHRHSD11B1ALDH1A1

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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103524420-A Keratin dyeing compounds, keratin dyeing compositions containing said compounds, and use thereof PROCTER & GAMBLE 2014-01-22 CN claimed
CN-102405036-B Keratin dyeing compositions comprising free radical scavengers and uses thereof PROCTER & GAMBLE 2013-09-18 CN claimed
CN-102405036-A Keratin dyeing compositions comprising free radical scavengers and uses thereof PROCTER & GAMBLE 2012-04-04 CN claimed
CN-102405080-A Keratin dyeing compositions comprising radical scavengers and chelating agents and uses thereof PROCTER & GAMBLE 2012-04-04 CN claimed
CN-1819989-A 2-(amino or substituted amino)-5-(substituted oxymethyl)-phenol compounds, dyeing compositions containing them, and use thereof PROCTER & GAMBLE (US) 2006-08-16 CN claimed
CN-1264498-C Primary intermediates for oxidative dyeing of hair PROCTER & GAMBLE (US) 2006-07-19 CN claimed
CN-1239467-C Primary intermediates for oxidative dyeing of hair P & G CLAIROL INC (US) 2006-02-01 CN claimed
CN-1229102-C Novel couplers for oxidative hair dyeing P & G CLAIROL INC (US) 2005-11-30 CN claimed
CN-1229100-C Primary intermediates for oxidative dyeing of hair P & G CLAIROL INC (US) 2005-11-30 CN claimed
CN-1219501-C Primary intermediates for oxidative dyeing of hair P & G CLAIROL INCORP (US) 2005-09-21 CN claimed
CN-1487816-A Primary intermediates for oxidative dyeing of hair P&G 2004-04-07 CN claimed
CN-1486170-A Novel couplers for use in oxidative hair dyeing P&G 2004-03-31 CN claimed
CN-1486297-A Primary intermediates for oxidative dyeing of hair P&G 2004-03-31 CN claimed
CN-1486172-A Primary intermediates for oxidative dyeing of hair P&G 2004-03-31 CN claimed
CN-1486171-A Couplers for oxidative hair dyeing P&G克莱罗尔公司 2004-03-31 CN claimed
CN-1477947-A Primary intermediates for oxidative dyeing of hair P&G 2004-02-25 CN claimed
CN-1474679-A Novel couplers for oxidative hair dyeing P&G 2004-02-11 CN claimed
CN-1474680-A Novel couplers for oxidative hair dyeing P&G克莱罗尔公司 2004-02-11 CN claimed
CN-1474681-A Novel couplers for oxidative hair dyeing P&G克莱罗尔公司 2004-02-11 CN claimed
CN-1449276-A Primary intermediates for oxidative dyeing of hair P & G CLAIROL INC (US) 2003-10-15 CN claimed