SCHEMBL1645737

SCHEMBL1645737

OCc1cnc(CS)c(O)c1CO

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDXK O00764 3/20 0.56
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 1/20 0.56
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
AOX1 Q06278 1/20 0.35
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
DPP4 P27487 1/20 0.31
GAA P10253 1/20 0.31

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
Hydrochloric Acid SCHEMBL11450069 0.91 PDXK (0.46) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL3761208 0.86 PDXK (0.62) PDXKKDM4EALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL11700751 0.84 ALDH1A1 (0.60) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4016022 0.81 KDM4E (0.61) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL2909398 0.81 PDXK (0.61) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11469014 0.80 KDM4E (0.47) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL11449347 0.77 KDM4E (0.56) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL4558720 0.77 PDXK (0.51) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL3900653 0.75 PDXK (0.50) PDXKKDM4EALDH1A1HPGDHSD17B10
SCHEMBL5500541 0.74 PDXK (0.49) PDXKKDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2482852-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES ThioMatrix Forschungs- und Beratungs GmbH (AT) 2012-08-08 EP claimed
WO-2011039259-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS- UND BERATUNGS GMBH (AT) 2011-04-07 WO claimed
EP-4380545-A1 MUCOADHESIVE OCULAR DELIVERY SYSTEM FOR THE TREATMENT OF GLAUCOMA Bioadhésive Ophthalmics (FR) 2024-06-12 EP disclosed
US-20230056811-A1 MUCOADHESIVE SOLID OR SEMISOLID OCULAR DELIVERY SYSTEMS BASED ON PREACTIVATED THIOMERS BIOADHESIVE OPHTHALMICS (FR) 2023-02-23 US disclosed
WO-2023012239-A1 MUCOADHESIVE OCULAR DELIVERY SYSTEM FOR THE TREATMENT OF GLAUCOMA BIOADHESIVE OPHTHALMICS (FR) 2023-02-09 WO disclosed
EP-4099979-A1 MUCOADHESIVE SOLID OR SEMISOLID OCULAR DELIVERY SYSTEMS BASED ON PREACTIVATED THIOMERS Bioadhésive Ophthalmics (FR) 2022-12-14 EP disclosed
WO-2021156435-A1 MUCOADHESIVE SOLID OR SEMISOLID OCULAR DELIVERY SYSTEMS BASED ON PREACTIVATED THIOMERS BIOADHESIVE OPHTHALMICS (FR) 2021-08-12 WO disclosed
US-10639377-B2 Mucoadhesive polymers having vitamin B partial structures THIOMATRIX FORSCHUNGS-UND BERATUNGS GMBH (AT) 2020-05-05 US disclosed
US-10639377-B2 Mucoadhesive polymers having vitamin B partial structures THIOMATRIX FORSCHUNGS-UND BERATUNGS GMBH (AT) 2020-05-05 US disclosed
EP-2482852-B1 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS- UND BERATUNGS GMBH (AT) 2017-11-22 EP disclosed
US-20150209434-A1 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS UND BERATUNGS GMBH (AT) 2015-07-30 US disclosed
US-20120225855-A1 TRIAZOLOPYRIDINE JAK INHIBITOR COMPOUNDS AND METHODS ZHU BING-YAN (US) 2012-09-06 US disclosed
US-20120225024-A1 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES YKK CORPORATION (JP) 2012-09-06 US disclosed
US-20120225024-A1 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES YKK CORPORATION (JP) 2012-09-06 US disclosed
EP-2482852-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES ThioMatrix Forschungs- und Beratungs GmbH (AT) 2012-08-08 EP disclosed
EP-2482852-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES ThioMatrix Forschungs- und Beratungs GmbH (AT) 2012-08-08 EP disclosed
CN-102596253-A Mucoadhesive polymers containing vitamin B substructures THIOMATRIX FORSCHUNGS UND BERATUNGS GMBH 2012-07-18 CN disclosed
WO-2011039259-A3 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS- UND BERATUNGS GMBH (AT) 2011-10-20 WO disclosed
WO-2011039259-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS- UND BERATUNGS GMBH (AT) 2011-04-07 WO disclosed
WO-2011039259-A2 MUCOADHESIVE POLYMERS HAVING VITAMIN B PARTIAL STRUCTURES THIOMATRIX FORSCHUNGS- UND BERATUNGS GMBH (AT) 2011-04-07 WO 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 (1 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-20120225855-A1 TRIAZOLOPYRIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 PDXK 216/4885KDM4E 2916/4885ALDH1A1 2375/4885

“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.