SCHEMBL4713050

SCHEMBL4713050

CCOC(=O)Cn1c(CCc2cccc(F)c2F)nc(=O)c2c1CCC2

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.43
▸ TSHR P16473 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ PLA2G7 Q13093 1/20 0.41
▸ KMT2A Q03164 3/20 0.39
▸ CYP2C9 P11712 2/20 0.37
▸ TP53 P04637 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ TRPM2 O94759 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PDCD1 Q15116 1/20 0.35
▸ CD274 Q9NZQ7 1/20 0.35
▸ POLB P06746 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
SCHEMBL2803850 0.86 FABP3 (0.40) KDM4EALDH1A1PLA2G7KMT2ACYP2C9
SCHEMBL14498583 0.82 TSHR (0.46) LMNAKDM4EALDH1A1TSHRMAPK1
SCHEMBL14498584 0.80 TSHR (0.48) LMNAKDM4EALDH1A1TSHRMAPK1
SCHEMBL4717983 0.80 CYP2C9 (0.52) KDM4EALDH1A1TSHRKMT2ACYP2C9
SCHEMBL4846348 0.79 CYP2C9 (0.53) KDM4EALDH1A1TSHRKMT2ACYP2C9
SCHEMBL4715145 0.78 KDM4E (0.44) KDM4EALDH1A1PLA2G7KMT2ACYP2C9
SCHEMBL4717043 0.78 HSD17B10 (0.39) KDM4EALDH1A1TSHRKMT2ACYP2C9
SCHEMBL4714932 0.77 CYP2C9 (0.40) LMNAKDM4EALDH1A1TSHRKMT2A
SCHEMBL16864572 0.76 PLA2G7 (0.57) PLA2G7CYP2C9
SCHEMBL2803815 0.74 PLA2G7 (0.66) PLA2G7CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7462620-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM, PLC (GB) 2008-12-09 — — US disclosed
US-7462620-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM, PLC (GB) 2008-12-09 — — US disclosed
US-7462620-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM, PLC (GB) 2008-12-09 — — US disclosed
EP-1337517-B1 PYRIMIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 2008-11-26 — — EP disclosed
US-7169924-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM PLC (GB) 2007-01-30 — — US disclosed
US-7169924-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM PLC (GB) 2007-01-30 — — US disclosed
US-7169924-B2 Pyrimidinone derivatives and their use in the treatment of atherosclerosis SMITHKLINE BEECHAM PLC (GB) 2007-01-30 — — US disclosed
US-20060241126-A1 Pyrimidinone Derivatives and Their Use in the Treatment of Atherosclerosis ELLIOTT RICHARD L 2006-10-26 — — US disclosed
EP-1337517-A1 PYRIMIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 2003-08-27 — — EP disclosed
WO-2002030911-A1 PYRIMIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM P.L.C. (GB) 2002-04-18 — — 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-20060241126-A1 Pyrimidinone Derivatives and Their Use in the Treatment of Atherosclerosis PLA2G7, PLA2G1B, PLA2G4B LMNA 410/4885KDM4E 3484/4885ALDH1A1 505/4885

“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.

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