SCHEMBL4661973

SCHEMBL4661973

OCc1ccc(OC2CCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
TSHR P16473 1/20 0.58
PARP10 Q53GL7 1/20 0.53
ALOX12 P18054 1/20 0.50
HRH1 P35367 1/20 0.49
FURIN P09958 2/20 0.46
FAAH O00519 1/20 0.45
EPHX2 P34913 1/20 0.45
ACACB O00763 3/20 0.45
LTA4H P09960 1/20 0.44
HRH3 Q9Y5N1 3/20 0.43
GRM2 Q14416 1/20 0.41

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
SCHEMBL7538656 0.96 ALDH1A1 (0.63) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL6671079 0.94 ALDH1A1 (0.61) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL16902888 0.92 FURIN (0.56) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL16902893 0.92 ALDH1A1 (0.53) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL12489770 0.92 ALDH1A1 (0.53) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL16702147 0.84 HRH3 (0.57) HRH3
SCHEMBL19050238 0.83 HRH1 (0.66) ALDH1A1TSHRALOX12HRH1FAAH
SCHEMBL14244255 0.80 ALDH1A1 (0.50) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL18715290 0.80 ALDH1A1 (0.50) ALDH1A1TSHRPARP10ALOX12HRH1
SCHEMBL16902873 0.80 ALDH1A1 (0.46) ALDH1A1TSHRALOX12FAAHEPHX2

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
EP-1364957-B1 GLYCOPYRANOSYLOXYPYRAZOLE DERIVATIVES AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2008-12-31 EP disclosed
US-7189702-B2 Glucopyranosyloxypyrazole derivatives and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2007-03-13 US disclosed
US-7087579-B2 Glucopyranosyloxypyrazole derivatives and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2006-08-08 US disclosed
US-20060142209-A1 Glucopyranosyloxypyrazole derivatives and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. 2006-06-29 US disclosed
US-20040132669-A1 Human sodium glucose co-transporter 2 (SGLT2) inhibitors; hypoglycemic agents, antidiabetic agents; obesity; prodrugs KISSEI PHARMACEUTICAL CO., LTD. (JP) 2004-07-08 US disclosed
EP-1364957-A1 GLYCOPYRANOSYLOXYPYRAZOLE DERIVATIVES AND MEDICINAL USE THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2003-11-26 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-20040132669-A1 Human sodium glucose co-transporter 2 (SGLT2) inhibitors; hypoglycemic agents, antidiabetic agents; obesity; prodrugs SLC5A2, SLC5A1, SLC2A1 ALDH1A1 596/4885TSHR 2295/4885PARP10 3983/4885
US-20060142209-A1 Glucopyranosyloxypyrazole derivatives and medicinal use thereof SLC5A2, SLC5A1, UGGT1 ALDH1A1 570/4885TSHR 2185/4885PARP10 3323/4885

“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.