SCHEMBL7754766

SCHEMBL7754766

CN(C)C(=O)N1CCc2ccc([N+](=O)[O-])cc21

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.55
LMNA P02545 2/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ROCK1 Q13464 1/20 0.44
DRD4 P21917 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
NOTUM Q6P988 1/20 0.43
HTR2C P28335 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL7749893 0.89 DRD4 (0.55) DRD2LMNANPC1MAPTHTT
SCHEMBL981641 0.85 NOTUM (0.60) DRD2LMNANPC1MAPTHTT
SCHEMBL27872558 0.84 DRD2 (0.57) DRD2LMNANPC1MAPTHTT
SCHEMBL2203452 0.84 DRD2 (0.58) DRD2LMNANPC1MAPTHTT
SCHEMBL3735431 0.83 DRD2 (0.56) DRD2LMNANPC1MAPTHTT
SCHEMBL29962960 0.81 DRD2 (0.52) DRD2LMNANPC1MAPTHTT
SCHEMBL29962149 0.81 DRD2 (0.52) DRD2LMNANPC1MAPTHTT
SCHEMBL3318846 0.81 DRD2 (0.52) DRD2LMNANPC1MAPTHTT
SCHEMBL2061374 0.80 HPGD (0.47) LMNANPC1MAPTHTTL3MBTL1
SCHEMBL8134006 0.79 DRD2 (0.58) DRD2LMNANPC1MAPTHTT

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
EP-0604278-B1 Indoline derivatives and dye compositions for keratinic fibres OREAL (FR) 2001-02-21 EP claimed
US-5427588-A Oxidation hair dyes; 1-oxy- or aminocarbonyl or oxy- or aminothiocarbonylindololines L'OREAL (FR) 1995-06-27 US claimed
EP-0604278-A1 Indoline derivatives and dye compositions for keratinic fibres L'OREAL (FR) 1994-06-29 EP claimed
JP-6263730-A None JP disclosed
EP-0604278-B1 Indoline derivatives and dye compositions for keratinic fibres OREAL (FR) 2001-02-21 EP disclosed
US-5556989-A HAIR DYES L'OREAL (FR) 1996-09-17 US disclosed
US-5534503-A 2'-O, N6 -disubstituted and 2'-O, N6, 2-trisubstituted adenosines and their medicinal uses SANDOZ LTD. (CH) 1996-07-09 US disclosed
US-5427588-A Oxidation hair dyes; 1-oxy- or aminocarbonyl or oxy- or aminothiocarbonylindololines L'OREAL (FR) 1995-06-27 US disclosed
JP-H06263730-A NOVEL INDOLINE COMPOUND, DYEING COMPOSITION COMPRISING THIS COMPOUND AS BASE AND DYEING PROCESS OF KERATINOUS FIBER L'OREAL SA 1994-09-20 JP disclosed
EP-0604278-A1 Indoline derivatives and dye compositions for keratinic fibres L'OREAL (FR) 1994-06-29 EP disclosed