SCHEMBL9819873

SCHEMBL9819873

CCOC(=O)C(CO)(CO)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 1/20 0.47
CYP4F2 P78329 3/20 0.41
CYP4A11 Q02928 3/20 0.41
ALDH1A1 P00352 4/20 0.40
PIN1 Q13526 1/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
HTT P42858 1/20 0.36
TSHR P16473 1/20 0.36
HCAR2 Q8TDS4 1/20 0.35

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
SCHEMBL371475 0.88 PKM (0.52) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL456197 0.84 MEN1 (0.48) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL30440649 0.82 MEN1 (0.47) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL8306724 0.82 MEN1 (0.47) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL27889242 0.82 MEN1 (0.47) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL14493769 0.82 PKM (0.47) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL13130109 0.82 PKM (0.52) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL11174634 0.80 MEN1 (0.50) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL17718041 0.80 MEN1 (0.50) PKMMEN1KMT2AKDM4ECYP4F2
SCHEMBL371476 0.78 CYP4F2 (0.47) PKMMEN1KMT2AKDM4ECYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269344-A1 Beta2-Adrenergic Receptor Agonists THERAVANCE BIOPHARMA R&D IP, LLC 2008-10-30 US disclosed
EP-0268460-B1 NEW PERCUTANEOUS ABSORPTION ENHANCERS, COMPOSITIONS CONTAINING SAME AND METHOD OF USE Macrochem Corporation (US) 1991-11-06 EP disclosed
US-4861764-A Percutaneous absorption enhancers, compositions containing same and method of use MACRO CHEM. CORP. (US) 1989-08-29 US disclosed
EP-0268460-A1 New percutaneous absorption enhancers, compositions containing same and method of use Macrochem Corporation (US) 1988-05-25 EP disclosed
US-4394329-A PLASTICIZING, EXPLOSIVES, VASODILATION, 2-HYDROXYMETHYL-1,3-PROPANEDIOL NITRATION THIOKOL CORPORATION (US) 1983-07-19 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 (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-20080269344-A1 Beta2-Adrenergic Receptor Agonists ADRB2, ADRB1, ADRA2B PKM 4054/4885MEN1 4705/4885KMT2A 4173/4885

“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.