SCHEMBL4811057

SCHEMBL4811057

CC(=O)c1ccc(Cc2ccccc2O)cc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.65
KMT2A Q03164 1/20 0.62
KEAP1 Q14145 1/20 0.61
HSPA5 P11021 1/20 0.52
TSHR P16473 1/20 0.49
SLC7A5 Q01650 1/20 0.48
MAOB P27338 4/20 0.47
HSD17B1 P14061 1/20 0.47
PKM P14618 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
AKR1B1 P15121 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 2/20 0.43
MAOA P21397 1/20 0.43
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL6248551 0.84 TSHR (0.69) LMNAKEAP1HSPA5TSHRSLC7A5
SCHEMBL14541452 0.84 LMNA (0.67) LMNAKMT2ATSHRMAOBSMN1; SMN2
Acetic Acid SCHEMBL9081320 0.83 KEAP1 (0.62) LMNAKMT2AKEAP1HSPA5SLC7A5
SCHEMBL30616875 0.82 KEAP1 (0.86) KMT2AKEAP1HSPA5TSHRPKM
SCHEMBL9776607 0.82 KEAP1 (0.86) KMT2AKEAP1HSPA5TSHRPKM
SCHEMBL11150843 0.82 LMNA (0.65) LMNAKMT2ATSHRMAOBSMN1; SMN2
SCHEMBL4001426 0.82 PLA2G10 (0.65) LMNAKEAP1HSPA5TSHRSLC7A5
SCHEMBL2579068 0.81 KEAP1 (0.56) LMNAKEAP1HSPA5TSHRMAPT
SCHEMBL12812400 0.81 LMNA (0.62) LMNAKMT2ATSHRMAOBPKM
SCHEMBL6246739 0.79 HSP90AA1 (0.56) LMNAKMT2AKEAP1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7414072-B2 Aryl 5-thio-β-d-glucopyranoside derivatives and therapeutic agents for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-08-19 US disclosed
CN-100341885-C Process for selective production of aryl 5-thio-beta-d-aldohexopyranosides TAISHO PHARMACEUTICAL CO LTD (JP) 2007-10-10 CN disclosed
US-7250522-B2 Method for selective preparation of aryl 5-thio-β-D-aldohexopyranosides TAISHO PHARMACEUTICAL CO., LTD. (JP) 2007-07-31 US disclosed
CN-1312165-C Aryl 5-thio-beta-D-glucopyranoside derivative and therapeutic agent for diabetes containing the same TAISHO PHARMACEUTICAL CO LTD (JP) 2007-04-25 CN disclosed
US-20050256317-A1 Process for selective production of aryl 5-thio-beta-d- aldohexopyranosides TAISHO PHARMACEUTICAL CO., LTD. (JP) 2005-11-17 US disclosed
CN-1675233-A Process for selective production of aryl 5-thio-beta-d-aldohexopyranosides TAISHO PHARMACEUTICAL CO LTD (JP) 2005-09-28 CN disclosed
US-20050209309-A1 Aryl 5-thio-beta-d-glucopyranoside derivatives and remedies for diabetes containing the same TAISHO PHARMACEUTICAL CO., LTD. 2005-09-22 US disclosed
CN-1639180-A Aryl 5-thio-beta-D-glucopyranoside derivatives and remedies for diabetes containing the same TAISHO PHARMACEUTICAL CO LTD (JP) 2005-07-13 CN disclosed
EP-1541578-A1 PROCESS FOR SELECTIVE PRODUCTION OF ARYL 5-THIO-BETA-D-ALDOHEXOPYRANOSIDES TAISHO PHARMACEUTICAL CO., LTD (JP) 2005-06-15 EP disclosed
EP-1528066-A1 ARYL 5-THIO-D-GLUCOPYRANOSIDE DERIVATIVES AND REMEDIES FOR DIABETES CONTAINING THE SAME TAISHO PHARMACEUTICAL CO., LTD (JP) 2005-05-04 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-20050256317-A1 Process for selective production of aryl 5-thio-beta-d- aldohexopyranosides ALDOA, DERA, AKR1D1 LMNA 4746/4885KMT2A 3446/4885KEAP1 1983/4885
US-20050209309-A1 Aryl 5-thio-beta-d-glucopyranoside derivatives and remedies for diabetes containing the same SLC5A2, SLC5A1, UGGT1 LMNA 4370/4885KMT2A 1778/4885KEAP1 238/4885

“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.