SCHEMBL5839697

SCHEMBL5839697

CCCCCCCCCCCCC1(C)CCc2c(C=O)c(OC)c(C)c(C)c2O1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PDE4A P27815 1/20 0.43
PDE3A Q14432 1/20 0.43
GSTO1 P78417 2/20 0.42
PTPN1 P18031 1/20 0.42
AKT1 P31749 1/20 0.40
ALOX5 P09917 1/20 0.39
CYP4F2 P78329 1/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 2/20 0.38
GSTP1 P09211 1/20 0.38
TTPA P49638 1/20 0.38
USP2 O75604 1/20 0.38
THRB P10828 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NR1I2 O75469 1/20 0.38

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
SCHEMBL5839133 1.00 PSEN1 (0.44) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL14544421 0.87 PSEN1 (0.50) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL5838691 0.83 MEN1 (0.45) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL4257412 0.82 MEN1 (0.66) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL5838888 0.81 PSEN1 (0.51) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL5839052 0.81 PSEN1 (0.51) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL5838659 0.81 PSEN1 (0.43) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL13084640 0.79 PSEN1 (0.55) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL5839784 0.78 PDE4D (0.36) PSEN1MEN1KMT2APDE4APDE3A
SCHEMBL12064998 0.78 PSEN1 (0.66) PSEN1MEN1KMT2APDE4APDE3A

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-7115657-B2 Bifunctional agents possessing antioxidant and antiarrhythmic activity UNI-PHARMA KLEON TSETIS PHARMACEUTICAL LABORATORIES S.A. (GR) 2006-10-03 US disclosed
US-20040259763-A1 Bifunctional agents possessing antioxidant and antiarrhythmic activity UNI-PHARMA KLEON TSETIS PHARMACEUTICAL LABORATORIES S.A. (GR) 2004-12-23 US disclosed
EP-1301504-B1 BIFUNCTIONAL AGENTS POSSESSING ANTIOXIDANT AND ANTIARRHYTHMIC ACTIVITY UNI PHARMA KLEON TSETIS PHARMACEUTICAL LAB SA (GR) 2004-11-03 EP disclosed
EP-1301504-A1 BIFUNCTIONAL AGENTS POSSESSING ANTIOXIDANT AND ANTIARRHYTHMIC ACTIVITY Uni-Pharma Kleon Tsetis Pharmaceutical Laboratories S.A. (GR) 2003-04-16 EP disclosed
WO-2002004438-A1 BIFUNCTIONAL AGENTS POSSESSING ANTIOXIDANT AND ANTIARRHYTHMIC ACTIVITY UNI-PHARMA KLEON TSETIS PHARMACEUTICAL LABORATORIES S.A. (GR) 2002-01-17 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-20040259763-A1 Bifunctional agents possessing antioxidant and antiarrhythmic activity GPX4, GSR, GPX1 PSEN1 4808/4885MEN1 4378/4885KMT2A 4310/4885

“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.