SCHEMBL3640753

SCHEMBL3640753

Cc1c(O)c2ccc(N(C)C)cc2[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
AR P10275 1/20 0.48
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DAO P14920 1/20 0.41
DDO Q99489 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
PRKAG1 P54619 1/20 0.40
PRKAA1 Q13131 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39

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
SCHEMBL3641750 0.88 KDM4E (0.51) KDM4EARKMT2AALDH1A1HPGD
SCHEMBL7988442 0.87 KDM4E (0.51) KDM4EARALDH1A1HPGDMAPT
SCHEMBL14437097 0.79 AR (0.47) KDM4EARKMT2AALDH1A1HPGD
SCHEMBL8001404 0.78 AR (0.45) KDM4EARALDH1A1HPGDMAPT
SCHEMBL3640988 0.76 KIF11 (0.50) KDM4EKMT2AALDH1A1HPGDDAO
SCHEMBL7254503 0.75 ALDH1A1 (0.47) KDM4EARKMT2AALDH1A1HPGD
SCHEMBL7999235 0.74 AR (0.40) KDM4EARKMT2AALDH1A1HPGD
SCHEMBL2268508 0.74 AR (0.61) KDM4EARKMT2AALDH1A1HPGD
SCHEMBL74712 0.73 AR (0.65) KDM4EARALDH1A1HPGDHSD17B10
SCHEMBL29379051 0.73 AR (0.65) KDM4EARALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2182914-A2 COMPOSITION OXIDATION COLOURING OF KERATINIC FIBRES, CONTAINING A CATIONIC CELLULOSE ETHER, A METASILICATE AND OXIDATION DYES, METHOD FOR OXIDATION COLOURING AND USES THEREOF L'Oreal (FR) 2010-05-12 EP disclosed
EP-2175830-A2 COMPOSITION FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC CELLULOSE ETHER, A WEAKLY OXYETHYLENATED SORBITAN FATTY ACID ESTER AND OXIDATION DYES L'Oreal (FR) 2010-04-21 EP disclosed
WO-2009019383-A2 COMPOSITION OXIDATION COLOURING OF KERATINIC FIBRES, CONTAINING A CATIONIC CELLULOSE ETHER, A METASILICATE AND OXIDATION DYES, METHOD FOR OXIDATION COLOURING AND USES THEREOF L'OREAL (FR) 2009-02-12 WO disclosed
WO-2009016061-A2 COMPOSITION FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC CELLULOSE ETHER, A WEAKLY OXYETHYLENATED SORBITAN FATTY ACID ESTER AND OXIDATION DYES L'OREAL (FR) 2009-02-05 WO disclosed