SCHEMBL4883406

SCHEMBL4883406

O=C(O)COc1ccc2cc(CO)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.67
ALOX15 P16050 2/20 0.53
TSHR P16473 1/20 0.53
HSD17B10 Q99714 1/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PTGS1 P23219 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MCL1 Q07820 1/20 0.49
LMNA P02545 1/20 0.47
CA2 P00918 1/20 0.47
PPARG P37231 2/20 0.47
POLB P06746 1/20 0.47
NCOA2 Q15596 1/20 0.47
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL4076964 0.87 PTPN7 (0.85) PTPN7ALOX15TSHRHSD17B10MEN1
SCHEMBL4883574 0.85 PTPN7 (0.65) PTPN7ALOX15TSHRHSD17B10MEN1
SCHEMBL166364 0.83 ALOX15 (0.63) PTPN7ALOX15TSHRHSD17B10MEN1
SCHEMBL4465276 0.81 LMNA (0.62) PTPN7ALOX15TSHRLMNACA2
SCHEMBL29367022 0.80 PTPN7 (1.00) PTPN7ALOX15MEN1KMT2AKDM4E
SCHEMBL25640 0.80 PTPN7 (1.00) PTPN7ALOX15MEN1KMT2AKDM4E
Ethylene Glycol SCHEMBL9493499 0.79 PTPN7 (0.90) PTPN7ALOX15MEN1KMT2AKDM4E
SCHEMBL15201762 0.79 PTPN7 (0.96) PTPN7ALOX15MEN1KMT2AKDM4E
SCHEMBL15201765 0.79 PTPN7 (0.96) PTPN7ALOX15MEN1KMT2AKDM4E
SCHEMBL9714119 0.79 PTPN7 (0.71) PTPN7ALOX15TSHRHSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080027094-A1 Tropane Compounds and Pharmaceutical Compositions Comprising the Same as an Active Ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 US disclosed
EP-1785421-A1 TROPAN COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 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 (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-20080027094-A1 Tropane Compounds and Pharmaceutical Compositions Comprising the Same as an Active Ingredient CHRM1, CHRM3, CHRM2 PTPN7 2784/4885ALOX15 3524/4885TSHR 78/4885

“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.