SCHEMBL2860807

SCHEMBL2860807

COC(=O)c1cc2[nH]c(-c3ccc(OCc4ccccc4)cc3OCc3ccccc3)c(-c3ccccc3)c2s1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.40
CSNK2A1 P68400 1/20 0.40
PPARG P37231 1/20 0.39
NR4A2 P43354 1/20 0.39
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
MAPK1 P28482 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HSP90AA1 P07900 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
SRD5A2 P31213 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
NOD2 Q9HC29 1/20 0.38
FFAR1 O14842 1/20 0.37

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
SCHEMBL2873096 0.90 PPARG (0.38) PPARGNR4A2MAPTKDM4EMAPK1
SCHEMBL2869800 0.86 MEN1 (0.38) PPARGNR4A2MAPTKDM4EMAPK1
SCHEMBL2871020 0.84 S1PR1 (0.37) CSNK2A2CSNK2A1KDM4EALDH1A1HSD17B10
SCHEMBL2860803 0.80 S1PR1 (0.35) CSNK2A2CSNK2A1FLT3PDE4APDE4B
SCHEMBL2860791 0.79 HPGD (0.40) CSNK2A2CSNK2A1PPARGNR4A2MAPT
SCHEMBL2987902 0.79 LMNA (0.45) CSNK2A2CSNK2A1NR4A2MAPTKDM4E
SCHEMBL427004 0.79 PPARG (0.47) PPARGNR4A2MAPTKDM4EHSP90AA1
SCHEMBL2156447 0.77 RAF1 (0.40) CSNK2A2CSNK2A1NR4A2MAPTKDM4E
SCHEMBL2868302 0.76 ALDH1A1 (0.40) CSNK2A2CSNK2A1NR4A2MAPTKDM4E
SCHEMBL2867469 0.76 MET (0.38) CSNK2A2CSNK2A1PPARGSRD5A2

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-7659263-B2 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2010-02-09 US disclosed
US-20060167246-A1 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2006-07-27 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-20060167246-A1 Thienopyrrole compound and use thereof as HCV polymerase inhibitor TPMT, JAK2, GTF3C5 CSNK2A2 1992/4885CSNK2A1 1392/4885PPARG 530/4885

“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.