SCHEMBL3207739

SCHEMBL3207739

CC(OC([O])=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
GAA P10253 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
MAPT P10636 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TSHR P16473 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 1/20 0.40

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
Bicarbonate SCHEMBL3270191 0.87 GAA (0.52) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL10407393 0.86 MTNR1A (0.51) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL10588831 0.86 MTNR1A (0.47) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL316898 0.84 MTNR1A (0.50) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL4652037 0.82 POLB (0.45) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL11147888 0.82 MTNR1A (0.49) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL159901 0.82 ELANE (0.46) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL5696832 0.82 MTNR1A (0.45) MTNR1AMTNR1BGAACYP1A2CYP2C9
Bicarbonate SCHEMBL11147890 0.82 MTNR1A (0.47) MTNR1AMTNR1BGAACYP1A2CYP2C9
SCHEMBL9840734 0.81 HCAR2 (0.53) MTNR1AMTNR1BGAACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5352774-A Colorfast blue dyes for plastics and synthetic fibers SANDOZ AG (CH) 1994-10-04 US claimed
US-5283326-A Coupling azo and cyanine dyes; colorfastness, heat resistance SANDOZ AG (CH) 1994-02-01 US claimed
EP-0251114-B1 THIENOTHIOPHENE DYES BASF Aktiengesellschaft (DE) 1990-05-02 EP claimed
US-4904777-A COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1990-02-27 US claimed
EP-0169483-B1 HETEROCYCLIC AZO DYES BASF Aktiengesellschaft (DE) 1989-11-15 EP claimed
US-4843153-A Azo dyes containing thienothiophene radicals as radicals of the diazo component BASF AKTIENGESELLSCHAFT (DE) 1989-06-27 US claimed
US-4837269-A FIBER-REACTIVE DISAZO DYES BASF AKTIENGESELLSCHAFT (DE) 1989-06-06 US claimed
US-4668775-A POLYESTERS, NYLON, CELLULOSE ESTERS, FIBERS, BLUE BASF AKTIENGESELLSCHAFT (DE) 1987-05-26 US claimed
US-4619992-A IMPROVED COLORFASTNESS BASF AKTIENGESELLSCHAFT (DE) 1986-10-28 US claimed
US-4496480-A Isothiazolazo dyes having coupling components which are free from unsaturated aliphatic radicals BASF AKTIENGESELLSCHAFT (DE) 1985-01-29 US claimed
US-7662540-B2 Support, photosensitive layer, protective film; photosensitive layer and protective film being formed in this order on support, wherein number of fish-eyes each having area of 2,000 mu m2 or more and maximum height measured from film surface of 1 mu m to 7 mu m residing in film is 50/m2-1,000/m2 FUJIFILM CORPORATION (JP) 2010-02-16 US disclosed
US-20080088813-A1 Support, photosensitive layer, protective film; photosensitive layer and protective film being formed in this order on support, wherein number of fish-eyes each having area of 2,000 mu m2 or more and maximum height measured from film surface of 1 mu m to 7 mu m residing in film is 50/m2-1,000/m2 FUJIFILM CORPORATION (JP) 2008-04-17 US disclosed
US-7223453-B2 Ink jet recording medium and ink jet recording method FUJIFILM CORPORATION (JP) 2007-05-29 US disclosed
EP-1525995-B1 Inkjet recording method FUJI PHOTO FILM CO LTD (JP) 2006-12-13 EP disclosed
US-7086726-B2 Inkjet recording method FUJI PHOTO FILM CO., LTD. (JP) 2006-08-08 US disclosed
EP-0156216-A1 Isothiazole azo dyestuffs BASF Aktiengesellschaft (DE) 1985-10-02 EP disclosed
EP-0087677-B1 ISOTHIAZOLAZO DYESTUFFS BASF Aktiengesellschaft (DE) 1985-07-17 EP disclosed
US-4496480-A Isothiazolazo dyes having coupling components which are free from unsaturated aliphatic radicals BASF AKTIENGESELLSCHAFT (DE) 1985-01-29 US disclosed
EP-0131757-A1 Disazo dyestuffs of the isothiazole series BASF Aktiengesellschaft (DE) 1985-01-23 EP disclosed
EP-0087677-A1 Isothiazolazo dyestuffs BASF Aktiengesellschaft (DE) 1983-09-07 EP disclosed