SCHEMBL5402094

SCHEMBL5402094

CCc1c(C(=O)OC(C)=O)cc(OC)c(OC)c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
POLB P06746 2/20 0.45
PTGS2 P35354 1/20 0.43
USP2 O75604 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HMGCR P04035 1/20 0.41
PKM P14618 1/20 0.39
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
PTPN1 P18031 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
GRIN2B Q13224 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
HTT P42858 2/20 0.37
KMT2A Q03164 2/20 0.36

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
SCHEMBL4551834 0.81 PKM (0.54) KDM4EPOLBPTGS2USP2HSD17B10
Hydrochloric Acid SCHEMBL6441563 0.79 KDM4E (0.47) KDM4EPOLBPTGS2USP2HSD17B10
SCHEMBL2083044 0.73 DRD2 (0.34) PTGS2USP2HMGCRPKMCYP3A4
SCHEMBL4809375 0.72 PKM (0.48) KDM4EPOLBPTGS2HSD17B10HMGCR
SCHEMBL7123362 0.72 MEN1 (0.56) CYP3A4HTTKMT2AGAASMN1; SMN2
SCHEMBL9255849 0.71 TSHR (0.36) KDM4EPOLBHSD17B10CYP3A4SMN1; SMN2
SCHEMBL31220629 0.71 SMN1; SMN2 (0.48) CYP2C9CYP2C19PTPN1SMN1; SMN2MAPT
SCHEMBL27527024 0.70 KDM4E (0.42) KDM4EPOLBPTGS2HMGCRHTT
SCHEMBL27856953 0.70 KDM4E (0.45) KDM4EPOLBPTGS2USP2HSD17B10
SCHEMBL11711686 0.69 ALDH1A1 (0.64) KDM4EPOLBKMT2ASMN1; SMN2MAPT

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-7217730-B2 Method for the use of pyranoindole derivatives to treat infection with Hepatitis C virus WYETH (US) 2007-05-15 US disclosed
EP-1509225-A1 METHOD FOR THE USE OF PYRANOINDOLE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS Wyeth (US) 2005-03-02 EP disclosed
US-20040082643-A1 Method for the use of pyranoindole derivatives to treat infection with Hepatitis C virus WYETH (US) 2004-04-29 US disclosed
WO-2003099275-A1 METHOD FOR THE USE OF PYRANOINDOLE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2003-12-04 WO disclosed
WO-2000027394-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2000-05-18 WO 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-20040082643-A1 Method for the use of pyranoindole derivatives to treat infection with Hepatitis C virus HAVCR2, HCCS, ZC3HAV1 KDM4E 2244/4885POLB 4428/4885PTGS2 3060/4885

“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.