SCHEMBL8749218

SCHEMBL8749218

O=[N+]([O-])c1ccc(O)c(NCCO)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
TSHR P16473 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 6/20 0.52
MEN1 O00255 4/20 0.51
PABPC1 P11940 1/20 0.51
DUSP3 P51452 1/20 0.51
PTPN5 P54829 1/20 0.51
PTPN11 Q06124 1/20 0.51
EIF4H Q15056 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 2/20 0.50
CXCR2 P25025 2/20 0.50
CXCR1 P25024 1/20 0.50
PKM P14618 1/20 0.50
KCNMA1 Q12791 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
TP53 P04637 1/20 0.50

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
SCHEMBL109470 0.87 KMT2A (0.67) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL126989 0.87 KMT2A (0.70) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL29390514 0.87 KMT2A (0.70) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL6896833 0.84 KMT2A (0.62) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL110398 0.83 KAT2B (0.68) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL113357 0.83 KMT2A (0.61) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL1844429 0.82 MAPT (0.54) KMT2ATSHRALDH1A1MEN1PABPC1
SCHEMBL10499506 0.82 RECQL (0.47) KMT2ATSHRTDP1ALDH1A1MEN1
SCHEMBL19381164 0.82 SMN1; SMN2 (0.54) KMT2ATSHRALDH1A1MEN1PABPC1
Water SCHEMBL9652876 0.82 SMN1; SMN2 (0.53) KMT2AALDH1A1MEN1PABPC1DUSP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0659399-B1 Process of direct hair using steam OREAL (FR) 1997-03-19 EP claimed
US-5496377-A HAIR DYES, NITRO-AMINE COMPOUNDS L'OREAL (FR) 1996-03-05 US claimed
EP-0659399-A1 Process of direct hair using steam L'OREAL (FR) 1995-06-28 EP claimed
CN-107072920-B Hair colouring layer, method and kit therefor 诺赛尔股份有限公司 2021-03-30 CN disclosed
CN-107072923-B Hair colouring layer, method and kit therefor 诺赛尔股份有限公司 2021-03-02 CN disclosed
EP-0659399-B1 Process of direct hair using steam OREAL (FR) 1997-03-19 EP disclosed
US-5496377-A HAIR DYES, NITRO-AMINE COMPOUNDS L'OREAL (FR) 1996-03-05 US disclosed
EP-0659399-A1 Process of direct hair using steam L'OREAL (FR) 1995-06-28 EP disclosed
EP-0145513-A2 Derivatives of dimethyl-3-nitro-4-amino-aniline, process for their preparation and their use in the dyeing of keratin fibres L'OREAL (FR) 1985-06-19 EP disclosed
US-4125601-A Substituted nitroaminophenols, process for their preparation and dyeing compositions in which they are present L'OREAL (FR) 1978-11-14 US disclosed
US-3930792-A NITROAMINOBENZENE, QUATERNARY AMINE, N-OXYALKYLATED FATTY ACID AMIDES CLAIROL INCORPORATED (US) 1976-01-06 US disclosed