SCHEMBL536617

SCHEMBL536617

O=C(CC1OC(=O)COC1=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.47
ALDH1A1 P00352 3/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
USP2 O75604 1/20 0.44
CDC25B P30305 1/20 0.39
KMT2A Q03164 3/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CASP1 P29466 2/20 0.38
CASP3 P42574 2/20 0.38
CASP7 P55210 2/20 0.38
CASP6 P55212 2/20 0.38
CASP8 Q14790 2/20 0.38
MEN1 O00255 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL567327 1.00 GLA (0.47) GLAALDH1A1MAPK1L3MBTL1USP2
SCHEMBL567494 0.87 ALDH1A1 (0.43) GLAALDH1A1MAPK1L3MBTL1USP2
SCHEMBL567024 0.87 ALDH1A1 (0.43) GLAALDH1A1MAPK1L3MBTL1USP2
SCHEMBL3978073 0.85 ALDH1A1 (0.41) GLAALDH1A1MAPK1L3MBTL1USP2
SCHEMBL3976930 0.83 EPHX2 (0.43) GLAALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL567091 0.78 LMNA (0.49) CDC25B
SCHEMBL567665 0.78 LMNA (0.49) CDC25B
SCHEMBL567608 0.77 HTT (0.51) KMT2AMEN1
SCHEMBL567366 0.77 HTT (0.51) KMT2AMEN1
SCHEMBL5501059 0.75 CTRB1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10501761-B2 Processing biomass to obtain hydroxylcarboxylic acids XYLECO, INC. (US) 2019-12-10 US claimed
US-9864251-B2 Color changeable device ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2018-01-09 US claimed
US-20160246151-A1 COLOR CHANGEABLE DEVICE ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2016-08-25 US claimed
US-20160076062-A1 PROCESSING BIOMASS TO OBTAIN HYDROXYLCARBOXYLIC ACIDS XYLECO, INC. 2016-03-17 US claimed
US-20160053047-A1 PROCESSING BIOMASS XYLECO, INC. 2016-02-25 US claimed
EP-2890794-A2 PROCESSING BIOMASS TO OBTAIN HYDROXYLCARBOXYLIC ACIDS Xyleco, Inc. (US) 2015-07-08 EP claimed
EP-2890804-A2 PROCESSING BIOMASS Xyleco, Inc. (US) 2015-07-08 EP claimed
WO-2014186670-A2 PROCESSING BIOMASS XYLECO, INC. (US) 2014-11-20 WO claimed
WO-2014176508-A2 PROCESSING BIOMASS TO OBTAIN HYDROXYLCARBOXYLIC ACIDS XYLECO, INC. (US) 2014-10-30 WO claimed
US-20200208180-A1 PROCESSING BIOMASS TO OBTAIN HYDROXYLCARBOXYLIC ACIDS XYLECO, INC. (US) 2020-07-02 US disclosed
US-10501761-B2 Processing biomass to obtain hydroxylcarboxylic acids XYLECO, INC. (US) 2019-12-10 US disclosed
US-20190322800-A1 PROCESSING HYDROXY-CARBOXYLIC ACIDS TO POLYMERS XYLECO, INC. (US) 2019-10-24 US disclosed
US-10174160-B2 Processing hydroxy-carboxylic acids to polymers XYLECO, INC. (US) 2019-01-08 US disclosed
US-20190002691-A1 COPOLYMER, PRODUCTION METHOD THEREOF, AND RESIN COMPOSITION MITSUI CHEMICALS INC (JP) 2019-01-03 US disclosed
US-6696500-B2 BIOACTIVE SUBSTANCE HAVING ACIDIC GROUP AND A BIODEGRADABLE POLYMER HAVING AN OPTIONALLY PROTECTED BASIC GROUP, SUCH AS A POLYLACTONE THAT HAS BEEN ESTERIFIED, AMIDATED, OR THIOESTERIFIED WITH A COMPOUND HAVING CYCLIC AMINO GROUPS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-02-24 US disclosed
US-6372844-B1 POLYLACTAM BLOCK POLYMERS OR GRAFT POLYMERS AND COPOLYMERS WITH ASPARTIC ACID MITSUI CHEMICALS, INC. (JP) 2002-04-16 US disclosed
US-20010038854-A1 Sustained-release preparation TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2001-11-08 US disclosed
US-6264970-B1 BIODEGRADABLE POLYMER TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1041118-A2 Resin composition Mitsui Chemicals, Inc. (JP) 2000-10-04 EP disclosed
EP-0815853-A2 Sustained-release preparation for bioactive substance having an acidic group TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-01-07 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160053047-A1 PROCESSING BIOMASS SCD, FASN, PFAS GLA 411/4885ALDH1A1 1704/4885MAPK1 2709/4885
US-20010038854-A1 Sustained-release preparation BMP2, PGF, AREG GLA 293/4885ALDH1A1 2581/4885MAPK1 4431/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.