SCHEMBL4251941

SCHEMBL4251941

CC1(c2ccccc2)C=Cc2c(ccc3cc(O)ccc23)O1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
APP P05067 2/20 0.36
HSP90AA1 P07900 2/20 0.36
XDH P47989 2/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
GAA P10253 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
MGAM O43451 1/20 0.35
NPSR1 Q6W5P4 2/20 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
SCHEMBL13779564 1.00 PTPN1 (0.40) PTPN1HTTSMN1; SMN2APPHSP90AA1
SCHEMBL4253743 0.84 APP (0.37) PTPN1HTTSMN1; SMN2APPHSP90AA1
SCHEMBL4254656 0.81 PTPN1 (0.56) PTPN1HSP90AA1XDHNPC1MGAM
SCHEMBL4251925 0.71 PTPN1 (0.57) PTPN1HSP90AA1XDHPTGS1PTGS2
SCHEMBL23861462 0.70 CDK4 (0.38) APPHSP90AA1ALDH1A1HPGDSIRT1
SCHEMBL7263829 0.68 SIRT2 (0.38) HTTSMN1; SMN2GAAMAPTMEN1
SCHEMBL364008 0.68 KDM4E (0.34) HTTSMN1; SMN2GAAMAPTMEN1
SCHEMBL5264237 0.68 CYP1A2 (0.41) HTTSMN1; SMN2GAAMAPTMEN1
SCHEMBL7128812 0.68 MAPT (0.40) HTTSMN1; SMN2GAAMAPTMEN1
SCHEMBL23861392 0.67 CDK4 (0.39) APPHSP90AA1GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170926-A1 Antiviral agents MONASH UNIVERISTY (AU) 2009-07-02 US disclosed
US-20090170926-A1 Antiviral agents MONASH UNIVERISTY (AU) 2009-07-02 US disclosed
US-20090170926-A1 Antiviral agents MONASH UNIVERISTY (AU) 2009-07-02 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-20090170926-A1 Antiviral agents SLC10A1, HAVCR2, ZC3HAV1 PTPN1 1233/4885HTT 4719/4885SMN1; SMN2 1692/4885

“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.