SCHEMBL4155315

SCHEMBL4155315

CCOC(=O)c1c(O)c2c(C)csc2[nH]c1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
KDM4E B2RXH2 1/20 0.49
KDM5A P29375 1/20 0.46
KDM5B Q9UGL1 1/20 0.46
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
APLNR P35414 1/20 0.41
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40

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
SCHEMBL2897758 0.82 LMNA (0.47) ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL2897779 0.80 PRKCZ (0.57) ALDH1A1KDM4EKDM5AKDM5BMAPT
SCHEMBL5919390 0.80 PRKCZ (0.47) ALDH1A1KDM4EKDM5AKDM5BMAPT
SCHEMBL4518265 0.78 KDM5A (0.52) ALDH1A1LMNAKDM4EKDM5AKDM5B
SCHEMBL26252901 0.78 ALDH1A1 (0.50) ALDH1A1LMNAKDM4EKDM5AKDM5B
SCHEMBL5919158 0.78 PRKAB2 (0.58) ALDH1A1LMNAKDM4EKDM5AKDM5B
SCHEMBL4158514 0.76 KDM5A (0.55) ALDH1A1LMNAKDM4EKDM5AKDM5B
SCHEMBL4144587 0.75 EGLN1 (0.40) ALDH1A1KDM4EERCC5FEN1
SCHEMBL8108086 0.73 ALDH1A1 (0.47) ALDH1A1KDM4EADRA2AADRA2BADRA2C
SCHEMBL321963 0.72 KDM5A (0.54) ALDH1A1LMNAKDM4EKDM5AKDM5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090176825-A1 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-09 US disclosed
US-7553849-B2 Compounds ACTIVE BIOTECH AB (SE) 2009-06-30 US disclosed
EP-1776369-B1 THIENOPYRIDONE CARBOXAMIDES AND THEIR MEDICAL USE ACTIVE BIOTECH AB (SE) 2007-10-10 EP disclosed
US-20060004038-A1 Novel compounds ACTIVE BIOTECH AB (SE) 2006-01-05 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 (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-20060004038-A1 Novel compounds REL, CLIC4, C5 ALDH1A1 3955/4885LMNA 4599/4885KDM4E 1493/4885
US-20090176825-A1 PROLYL HYDROXYLASE INHIBITORS HIF1AN, EGLN2, EGLN3 ALDH1A1 319/4885LMNA 3318/4885KDM4E 566/4885

“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.