SCHEMBL5484588

SCHEMBL5484588

O=C(O)CC(Oc1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.50
ALOX15 P16050 1/20 0.48
GABBR2 O75899 1/20 0.47
GABBR1 Q9UBS5 1/20 0.47
SLC6A9 P48067 5/20 0.45
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FFAR1 O14842 5/20 0.44
CYP2C19 P33261 1/20 0.43

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
SCHEMBL27520134 0.98 SLC6A4 (0.49) SLC6A4ALOX15GABBR2GABBR1SLC6A9
SCHEMBL1582685 0.88 SLC6A9 (0.56) SLC6A4SLC6A9FFAR1
SCHEMBL21391835 0.85 SLC6A4 (0.60) SLC6A4KMT2ASMN1; SMN2FFAR1
SCHEMBL18228719 0.85 SLC6A4 (0.60) SLC6A4KMT2ASMN1; SMN2FFAR1
SCHEMBL18228682 0.85 SLC6A4 (0.60) SLC6A4KMT2ASMN1; SMN2FFAR1
SCHEMBL10603027 0.85 SLC6A4 (0.51) SLC6A4SLC6A9KMT2AFFAR1
SCHEMBL9365996 0.83 PPARA (0.56) SLC6A4SLC6A9FFAR1
SCHEMBL18628041 0.82 SLC6A4 (0.45) SLC6A4ALOX15SLC6A9KMT2A
SCHEMBL18228723 0.81 SLC6A4 (0.56) SLC6A4SLC6A9FFAR1
SCHEMBL21959494 0.81 SLC6A4 (0.56) SLC6A4SLC6A9FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5117038-A HERBICIDAL SUBSTITUTED PHENOXYPHENYLPROPIONIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1992-05-26 US claimed
JP-51136644-A None JP disclosed
CN-112316206-B Implants containing resorbable metal materials and methods of making the same 中南大学湘雅三医院 2022-09-02 CN disclosed
CN-107531653-B Novel difluoroketoamide derivatives 豪夫迈·罗氏有限公司 2021-10-19 CN disclosed
CN-107207421-B Novel trifluoromethylpropionamide derivatives 豪夫迈·罗氏有限公司 2021-04-20 CN disclosed
CN-112316206-A Implants containing resorbable metallic materials and methods of making same 中南大学湘雅三医院 2021-02-05 CN disclosed
CN-112188887-A Methods and compositions for targeted delivery of active agents and immunomodulators to lymph nodes 免疫疫苗技术公司 2021-01-05 CN disclosed
US-7220780-B2 Naaladase inhibitors for treating retinal disorders and glaucoma GUILFORD PHARMACEUTICALS INC. (US) 2007-05-22 US disclosed
EP-1646718-A2 METHODS FOR THE STEREOSELECTIVE SYNTHESIS AND ENANTIOMERIC ENRICHMENT OF B-AMINO ACIDS Pharmacia Corporation (US) 2006-04-19 EP disclosed
WO-2005005633-A2 METHODS FOR THE STEREOSELECTIVE SYNTHESIS AND ENANTIOMERIC ENRICHMENT OF B-AMINO ACIDS PHARMACIA CORPORATION (US) 2005-01-20 WO disclosed
EP-0166186-A2 Derivatives of substituted phenoxyphenyl-propionic acid BAYER AG (DE) 1986-01-02 EP disclosed
EP-0166186-A2 Derivatives of substituted phenoxyphenyl-propionic acid BAYER AG (DE) 1986-01-02 EP disclosed
US-4468511-A C-20- And C-23-Modified macrolide derivatives ELI LILLY AND COMPANY (US) 1984-08-28 US disclosed
EP-0001064-B1 FLUOROSUBSTITUTED PHENOXYBENZYL-OXYCARBONYLDERIVATIVES, -ALCOHOLS AND -HALIDES, PROCESSES FOR THEIR PREPARATION AND THEIR APPLICATION BAYER AG (DE) 1982-07-07 EP disclosed
EP-0000345-B1 SUBSTITUTED PHENOXYBENZYLOXYCARBONYL DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INSECTICIDES AND ACARICIDES BAYER AG (DE) 1981-04-01 EP disclosed
US-4242357-A INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 1980-12-30 US disclosed
EP-0001064-A2 Fluorosubstituted phenoxybenzyl-oxycarbonylderivatives, -alcohols and -halides, processes for their preparation and their application BAYER AG (DE) 1979-03-21 EP disclosed
EP-0000345-A1 Substituted phenoxybenzyloxycarbonyl derivatives, their preparation and their use as insecticides and acaricides BAYER AG (DE) 1979-01-24 EP disclosed
JP-S51136644-A PROCESS FOR PREPARING META-SUBSTITUTED-PHENOXYPHENYLPROPIONIC ACID DER IVATIVES EISAI CO LTD 1976-11-26 JP disclosed
US-3937700-A Novel 1,2-methylene-17α-acyloxy (or improved hydroxy)-9β, 10α-steroid compounds of the pregnane series, pharmaceutic preparations on the basis of the novel compounds and methods of producing said compounds and preparations U.S. PHILIPS CORPORATION (US) 1976-02-10 US disclosed