SCHEMBL8009724

SCHEMBL8009724

CCOC(=O)Nc1cc(C)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.75
CYP2C9 P11712 1/20 0.75
CYP2C19 P33261 1/20 0.75
SMN1; SMN2 Q16637 2/20 0.68
NLRP3 Q96P20 1/20 0.59
KCNMA1 Q12791 4/20 0.58
GAA P10253 5/20 0.56
HTT P42858 2/20 0.55
MAPT P10636 2/20 0.54
POLB P06746 1/20 0.54
MAPK1 P28482 1/20 0.54
HPGD P15428 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 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
SCHEMBL9816008 0.88 CYP1A2 (0.58) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL7257110 0.85 MEN1 (0.72) CYP1A2CYP2C9CYP2C19SMN1; SMN2KCNMA1
SCHEMBL18473970 0.84 NLRP3 (0.79) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL7254155 0.84 ALDH1A1 (0.54) CYP1A2CYP2C9CYP2C19SMN1; SMN2GAA
SCHEMBL8006888 0.84 HPGD (0.72) CYP1A2CYP2C9CYP2C19SMN1; SMN2KCNMA1
SCHEMBL6287677 0.81 CYP1A2 (0.73) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL7257115 0.81 ALDH1A1 (0.64) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL12407193 0.81 SMN1; SMN2 (1.00) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL10192134 0.80 CYP1A2 (0.71) CYP1A2CYP2C9CYP2C19SMN1; SMN2NLRP3
SCHEMBL6397287 0.80 KCNMA1 (0.69) SMN1; SMN2KCNMA1GAAHTTMAPT

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 64 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102827094-A 2,3,6(8)-tri-substituted-3,4-dihydro-2H-1,3-benzoxazines compound UNIV HUNAN SCI & TECHNOLOGY 2012-12-19 CN disclosed
EP-0648816-B1 Dyeing of leather with dyestuff mixtures CIBA SC HOLDING AG (CH) 2000-01-26 EP disclosed
EP-0648816-A1 Dyeing of leather with dyestuff mixtures CIBA-GEIGY AG (CH) 1995-04-19 EP disclosed
US-5204453-A Process for the preparation of 1:2 metal complex azo compounds by carrying out diazotization and coupling in the presence of a metal donor CIBA-GEIGY CORPORATION (US) 1993-04-20 US disclosed
US-5002586-A Dyeing and printing of leather SANDOZ LTD. (CH) 1991-03-26 US disclosed
US-5001227-A Fibre-reactive 1:1 chromium complex azo or azomethine dyes having a bidentate chelating group and a monofunctional neutral ligand CIBA-GEIGY CORPORATION (US) 1991-03-19 US disclosed
US-4990598-A Colorfastness CIBA-GEIGY CORPORATION, A CORP. OF NEW YORK 1991-02-05 US disclosed
US-4960870-A DYEING WOOL, POLYAMIDES; FIBER REACTIVE DYES CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed
US-4874848-A FOR DYEING WOOL, LEATHER, POLYAMIDES BLACK OR BROWN CIBA-GEIGY CORPORATION (US) 1989-10-17 US disclosed
US-4874849-A FOR DYEING WOOL, POLYAMIDES, LEATHER ORANGE OR BROWN CIBA-GEIGY CORPORATION (US) 1989-10-17 US disclosed
EP-0048693-A2 Disazo dyestuffs, metal complexes thereof, their preparation and use CIBA-GEIGY AG (CH) 1982-03-31 EP disclosed
US-4318849-A COPPER, NICKEL, CHROMIUM OR COBALT COMPLEXES OF AZO OR AZO-METHINE DYES CIBA-GEIGY CORPORATION (US) 1982-03-09 US disclosed
US-4256633-A AZO DYES; AZOMETHINE DYES; WOOL, POLYAMIDES, AND LEATHER CIBA-GEIGY CORPORATION (US) 1981-03-17 US disclosed
US-4215042-A PRINTING AND DYEING OF POLYAMIDES; COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1980-07-29 US disclosed
US-4116952-A POLYAMIDES CIBA-GEIGY CORPORATION (US) 1978-09-26 US disclosed
US-RE29585-E DYEING WOOL CIBA-GEIGY CORPORATION (US) 1978-03-21 US disclosed
US-4033942-A Chromium complex dye, including azo and azo methine dye compounds CIBA-GEIGY AG (CH) 1977-07-05 US disclosed
US-3978037-A POLYAMIDES CIBA-GEIGY CORPORATION (US) 1976-08-31 US disclosed
US-3971738-A Heavy metal complexes of azo compounds containing a halogeno-2,3-dihydroxy pyridine coupling component CIBA-GEIGY AG (CH) 1976-07-27 US disclosed
US-3933785-A Azo compounds CIBA-GEIGY AG (CH) 1976-01-20 US disclosed