SCHEMBL3674521

SCHEMBL3674521

CCCCCCCCC(CC)C(CC)(C(=O)OCC)P(=O)(O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDPS P14324 5/20 0.49
SMPD1 P17405 3/20 0.40
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LAP3 P28838 1/20 0.37
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
LPAR3 Q9UBY5 4/20 0.36
LPAR1 Q92633 3/20 0.36
LPAR2 Q9HBW0 3/20 0.36
GGPS1 O95749 1/20 0.36
ZDHHC7 Q9NXF8 1/20 0.36
LPAR6 P43657 1/20 0.35
LPAR4 Q99677 1/20 0.35
LPAR5 Q9H1C0 1/20 0.35
ENPP2 Q13822 1/20 0.35

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
SCHEMBL9234022 0.99 FDPS (0.46) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL9000621 0.94 FDPS (0.44) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL3675754 0.88 POLB (0.36) FDPS
SCHEMBL3889930 0.85 MMP8 (0.37) MEN1KMT2AL3MBTL1LMNA
SCHEMBL9380998 0.81 CYP4F2 (0.36) MEN1KMT2A
SCHEMBL2353089 0.78 MEN1 (0.43) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL2349851 0.78 MEN1 (0.43) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL2350480 0.78 MEN1 (0.43) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL2352898 0.78 MEN1 (0.43) FDPSSMPD1MEN1MAPTKMT2A
SCHEMBL2357271 0.78 MEN1 (0.43) FDPSSMPD1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203161-B1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF UNIV INDIANA RES & TECH CORP (US) 2018-05-09 EP disclosed
US-9089605-B2 Quinone derivatives, pharmaceutical compositions, and uses thereof INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2015-07-28 US disclosed
US-20100297113-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF PURDUE RESEARCH FOUNDATION 2010-11-25 US disclosed
EP-2203161-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Indiana University Research and Technology Corporation (US) 2010-07-07 EP disclosed
WO-2009042544-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2009-04-02 WO disclosed
EP-0419905-B1 Quinone derivatives and pharmacological use EISAI CO LTD (JP) 1996-01-17 EP disclosed
US-5385942-A Therapy of cirrhosis, liver disorders EISAI CO., LTD. (JP) 1995-01-31 US disclosed
US-5210239-A Treatment of Hepatic Diseases EISAI CO., LTD. (JP) 1993-05-11 US disclosed
EP-0419905-A2 Quinone derivatives and pharmacological use Eisai Co., Ltd. (JP) 1991-04-03 EP 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-20100297113-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF APEX1, NQO1, REV1 FDPS 1009/4885SMPD1 2896/4885MEN1 2751/4885

“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.