SCHEMBL11095264

SCHEMBL11095264

Cc1c(O)cc(N)cc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.58
MAPK1 P28482 2/20 0.58
HSD17B10 Q99714 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
ALDH1A1 P00352 5/20 0.53
TSHR P16473 4/20 0.53
CYP3A4 P08684 3/20 0.53
RECQL P46063 1/20 0.53
GPR35 Q9HC97 5/20 0.48
TDP1 Q9NUW8 3/20 0.47
CYP1A2 P05177 1/20 0.44
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SNCA P37840 1/20 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
SCHEMBL314000 0.87 TSHR (0.61) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL1330407 0.82 TSHR (0.55) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL13176891 0.82 TSHR (0.60) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL11113072 0.82 GPR35 (0.67) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL629679 0.82 TSHR (0.55) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL29577133 0.80 GPR35 (0.66) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL3132904 0.80 GPR35 (0.66) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL14155059 0.79 ALOX15 (0.64) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL27801299 0.79 ALDH1A1 (0.49) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1
SCHEMBL8059114 0.79 GPR35 (0.61) ALOX15MAPK1HSD17B10L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4473374-A Nitrated coupler compounds useful in direct dyeing and simultaneous oxidation and direct dyeing of keratinic fibers SOCIETE ANONYME DITE: L'OREAL (FR) 1984-09-25 US disclosed
US-4330291-A Nitrated coupler compounds useful in direct dyeing and simultaneous oxidation and direct dyeing of keratinic fibers SOCIETE ANONYME DITE: L'OREAL (FR) 1982-05-18 US disclosed