SCHEMBL2156283

SCHEMBL2156283

COC(=O)c1cc2[nH]c(-c3ccccc3OC[C@@H]3CO3)c(-c3ccccc3)c2s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.37
ALDH1A1 P00352 3/20 0.37
GLA P06280 2/20 0.37
BRD4 O60885 2/20 0.36
ADRA1B P35368 1/20 0.36
KDM4E B2RXH2 8/20 0.35
L3MBTL1 Q9Y468 4/20 0.34
GAA P10253 3/20 0.34
HPGD P15428 2/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
ATM Q13315 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 2/20 0.33
TLR9 Q9NR96 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL2156276 0.84 BRD4 (0.37) ALDH1A1GLABRD4ADRA1BKDM4E
SCHEMBL2156447 0.79 RAF1 (0.40) ALDH1A1GLAKDM4EL3MBTL1GAA
SCHEMBL2987902 0.78 LMNA (0.45) ALDH1A1KDM4EL3MBTL1GAAHPGD
SCHEMBL2868302 0.78 ALDH1A1 (0.40) ALDH1A1GLAKDM4EL3MBTL1GAA
SCHEMBL2860807 0.76 CSNK2A2 (0.40) ALDH1A1KDM4EHPGDTSHRMAPK1
SCHEMBL2157797 0.75 LMNA (0.37) ALDH1A1GLAKDM4EL3MBTL1GAA
SCHEMBL14527095 0.73 ALDH1A1 (0.54) ALDH1A1GLAKDM4EL3MBTL1GAA
SCHEMBL2986582 0.72 PTGS2 (0.42) ALDH1A1KDM4EHPGD
SCHEMBL2873096 0.71 PPARG (0.38) ALDH1A1KDM4EHPGDTSHRMAPK1
SCHEMBL2867800 0.71 FBP1 (0.36) ALDH1A1ADRA1BKDM4EHPGDMEN1

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-7973026-B2 Thienopyrroles as antiviral agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-07-05 US disclosed
US-20090105227-A1 Thienopyrroles As Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-04-23 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-20090105227-A1 Thienopyrroles As Antiviral Agents ZC3HAV1, HAVCR2, ZC3HAV1L PTPN1 459/4885ALDH1A1 433/4885GLA 3758/4885

“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.