SCHEMBL8346957

SCHEMBL8346957

CCc1c([N+](=O)[O-])ccc2c(C)c[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FBP1 P09467 3/20 0.43
▸ MAPT P10636 4/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TSHR P16473 3/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ TDP1 Q9NUW8 3/20 0.37
▸ DNA2 P51530 1/20 0.36
▸ CASP6 P55212 1/20 0.36
▸ CTDSP1 Q9GZU7 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ REN P00797 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL28312938 0.78 MAPT (0.57) FBP1MAPTL3MBTL1NPC1MAPK1
SCHEMBL8349117 0.72 REN (0.45) MAPTSMN1; SMN2HSD17B10RENKDM4E
SCHEMBL8352901 0.72 FBP1 (0.39) FBP1MAPTTSHRTDP1CYP3A4
SCHEMBL13236290 0.72 TSHR (0.50) FBP1MAPTL3MBTL1TSHRSMN1; SMN2
SCHEMBL13236484 0.72 TSHR (0.60) FBP1MAPTL3MBTL1NPC1MAPK1
SCHEMBL8361517 0.70 TDP1 (0.58) FBP1MAPTL3MBTL1NPC1TSHR
SCHEMBL7031187 0.70 CYP3A4 (0.43) FBP1MAPTL3MBTL1NPC1MAPK1
SCHEMBL15173799 0.69 TSHR (0.49) MAPTTSHRSMN1; SMN2TDP1HSD17B10
SCHEMBL15173207 0.69 CYP1A2 (0.44) FBP1MAPTL3MBTL1TSHRSMN1; SMN2
SCHEMBL13715228 0.68 ALDH1A1 (0.57) MAPTNPC1MAPK1TSHRSMN1; SMN2

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
US-5938792-A APPLYING TO KERATINOUS FIBERS UNDER BASIC CONDITIONS COMPOSITION COMPRISING AMINOINDOLE COUPLER, OXIDATION DYE PRECURSOR, OXIDIZING AGENT L'OREAL (FR) 1999-08-17 — — US disclosed
US-5752982-A DYEING HAIR IN LIGHTFAST, WASHFAST COLORS L'OREAL (FR) 1998-05-19 — — US disclosed
EP-0580713-B1 METHOD FOR DYEING KERATIN FIBRES WITH AMINOINDOLES HAVING ALKALINE pH, AND COMPOSITIONS THEREFOR OREAL (FR) 1995-03-01 — — EP disclosed
EP-0460996-B1 Keratinic fibres dyeing process with an aminoindol associated with a quinone derivative OREAL (FR) 1994-09-14 — — EP disclosed
EP-0580713-A1 METHOD FOR DYEING KERATIN FIBRES WITH AMINOINDOLES HAVING ALKALINE pH, AND COMPOSITIONS THEREFOR. OREAL (FR) 1994-02-02 — — EP disclosed
EP-0578735-A1 NOVEL KERATIN FIBRE DYEING METHOD USING AMINOINDOLES, WITH ACID pH, COMPOSITIONS THEREFOR AND NOVEL AMINOINDOLE COMPOUNDS. OREAL (FR) 1994-01-19 — — EP disclosed
US-5180400-A METHOD FOR DYEING KERATINOUS FIBRES USING AN AMINOINDOLE IN COMBINATION WITH A QUINONE DERIVATIVE L'OREAL (FR) 1993-01-19 — — US disclosed
WO-1992018093-A1 METHOD FOR DYEING KERATIN FIBRES WITH AMINOINDOLES HAVING ALKALINE pH, AND COMPOSITIONS THEREFOR L'OREAL (FR) 1992-10-29 — — WO disclosed
WO-1992017157-A1 NOVEL KERATIN FIBRE DYEING METHOD USING AMINOINDOLES, WITH ACID pH, COMPOSITIONS THEREFOR AND NOVEL AMINOINDOLE COMPOUNDS L'OREAL (FR) 1992-10-15 — — WO disclosed
EP-0460996-A1 Keratinic fibres dyeing process with an aminoindol associated with a quinone derivative L'OREAL (FR) 1991-12-11 — — EP disclosed
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