SCHEMBL147405

SCHEMBL147405

Cc1ccc(Cl)c(Cc2ccc(-c3ccc(C(=O)N(C)C)cc3)s2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.42
HSD17B1 P14061 7/20 0.40
HSD17B2 P37059 7/20 0.40
HDAC6 Q9UBN7 1/20 0.38
MAPK11 Q15759 2/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK14 Q16539 1/20 0.38
PRF1 P14222 1/20 0.38
PDK1 Q15118 1/20 0.37
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
CYP2C19 P33261 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL146792 0.82 APP (0.42) HSD17B1HSD17B2SLC5A1SLC5A2ALDH1A1
SCHEMBL9975462 0.82 HSD17B1 (0.46) HSD17B1HSD17B2SLC5A1SLC5A2
SCHEMBL146793 0.81 KMT2A (0.38) MAPK14ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL16136882 0.80 HPGD (0.49) MAPK14PRF1ALDH1A1HPGDTSHR
SCHEMBL14278458 0.79 CYP2A6 (0.45) HSD17B1HSD17B2SLC5A1SLC5A2ALDH1A1
SCHEMBL148158 0.79 CYP2A6 (0.37) HSD17B1HSD17B2SLC5A1SLC5A2ALDH1A1
SCHEMBL147520 0.79 PRF1 (0.43) HSD17B1HSD17B2PRF1SLC5A2
SCHEMBL147481 0.77 SLC5A2 (0.40) HSD17B1HSD17B2SLC5A1SLC5A2LMNA
SCHEMBL147396 0.77 APP (0.49) ALDH1A1CYP1A2CYP3A4TSHRCYP2C19
SCHEMBL148014 0.75 SLC5A2 (0.41) HSD17B1HSD17B2SLC5A1SLC5A2KDM4E

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160108078-A1 GLUCOPYRANOSIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-04-21 US disclosed
US-20140296506-A1 GLUCOPYRANOSIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-10-02 US disclosed
US-8785403-B2 Glucopyranoside compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-07-22 US disclosed
US-20120258913-A1 GLUCOPYRANOSIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-10-11 US disclosed
US-8222219-B2 Glucopyranoside compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-07-17 US disclosed
US-8202984-B2 Glucopyranoside compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-06-19 US disclosed
US-20120058941-A1 GLUCOPYRANOSIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-03-08 US disclosed
US-7943788-B2 Including the antidiabetic, antiobesity sodium glucose transport inhibitor Canagliflozin (1-( beta -D-glucopyranosyl)-4-methyl-3-[5-(4-fluorophenyl)-2-thienylmethyl]benzene) MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-17 US disclosed
US-20110105424-A1 GLUCOPYRANOSIDE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-05 US 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 (5 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-20120058941-A1 GLUCOPYRANOSIDE COMPOUND UGGT1, B3GAT3, FUT6 RORC 1331/4885HSD17B1 268/4885HSD17B2 195/4885
US-20110105424-A1 GLUCOPYRANOSIDE COMPOUND UGGT1, B3GAT3, FUT6 RORC 1331/4885HSD17B1 268/4885HSD17B2 195/4885
US-20120258913-A1 GLUCOPYRANOSIDE COMPOUND UGGT1, B3GAT3, FUT6 RORC 1331/4885HSD17B1 268/4885HSD17B2 195/4885
US-20160108078-A1 GLUCOPYRANOSIDE COMPOUND UGGT1, B3GAT3, FUT6 RORC 1331/4885HSD17B1 268/4885HSD17B2 195/4885
US-20140296506-A1 GLUCOPYRANOSIDE COMPOUND UGGT1, B3GAT3, FUT6 RORC 1331/4885HSD17B1 268/4885HSD17B2 195/4885

“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.