Mequinol

Mequinol

SCHEMBL8924974

COc1ccc(O)cc1.Cc1cccc2cc3ccccc3cc12

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TYR

The experimentally established mechanism targets of Mequinol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
LTA4H P09960 1/20 0.47
ESR2 Q92731 1/20 0.47
APP P05067 2/20 0.44
CYP2A6 P11509 2/20 0.43
MAPT P10636 2/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42

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
Anthracene SCHEMBL8925919 0.84 ESR2 (0.64) CYP1A2LTA4HESR2APPCYP2A6
1-Hydroxy-4-Ethoxybenzene SCHEMBL10587905 0.83 LTA4H (0.51) CYP1A2ALDH1A1HPGDHSD17B10LTA4H
Mequinol SCHEMBL10589275 0.83 LTA4H (0.46) CYP1A2LTA4HESR2APPCYP2A6
SCHEMBL130783 0.80 CYP1A2 (0.69) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
Mequinol SCHEMBL8923068 0.80 MCL1 (0.58) CYP1A2LTA4HESR2APPCYP2A6
SCHEMBL11054996 0.80 CYP1A2 (0.55) CYP1A2ALDH1A1HPGDHSD17B10ESR2
SCHEMBL1309620 0.78 CYP1A2 (0.67) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL5400012 0.78 CYP1A2 (0.67) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL31498551 0.78 CYP1A2 (0.67) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL28536961 0.78 CYP1A2 (0.67) CYP1A2ALDH1A1HPGDHSD17B10CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663032-A NAPHTHOL DERIVATIVE REDUCING AGENT CANON KABUSHIKI KAISHA (JP) 1997-09-02 US disclosed
EP-0332455-B1 Photosensitive material and image forming method CANON KK (JP) 1996-06-05 EP disclosed
EP-0653680-A2 Photosensitive composition, photosensitive material and image forming method CANON KABUSHIKI KAISHA (JP) 1995-05-17 EP disclosed
US-5041369-A Silver Halide, Silver Salt, Reducing Agent, Metal or Organic Dye CANON KABUSHIKI KAISHA (JP) 1991-08-20 US disclosed
EP-0332455-A2 Photosensitive material and image forming method CANON KABUSHIKI KAISHA (JP) 1989-09-13 EP disclosed
EP-0326424-A2 Photosensitive composition, photosensitive material, and image forming method CANON KABUSHIKI KAISHA (JP) 1989-08-02 EP disclosed