SCHEMBL4713987

SCHEMBL4713987

O=Cc1ccc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.67
ALDH1A1 P00352 2/20 0.65
GAA P10253 2/20 0.65
PKM P14618 1/20 0.63
KDM4E B2RXH2 1/20 0.58
POLB P06746 1/20 0.53
HTT P42858 2/20 0.53
LMNA P02545 2/20 0.53
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL2798288 0.95 USP2 (0.74) USP2ALDH1A1GAAPOLBHTT
SCHEMBL5804200 0.95 USP2 (0.74) USP2ALDH1A1GAAPOLBHTT
SCHEMBL1987080 0.93 USP2 (0.70) USP2ALDH1A1GAAPKMPOLB
SCHEMBL23884609 0.80 KMT2A (0.68) USP2ALDH1A1PKMPOLBHTT
SCHEMBL5407453 0.79 ALDH1A1 (1.00) USP2ALDH1A1GAAPKMKDM4E
SCHEMBL23884850 0.78 ALDH1A1 (0.68) ALDH1A1GAAKDM4ELMNAMEN1
SCHEMBL848317 0.78 SMN1; SMN2 (0.68) USP2ALDH1A1POLBHTTLMNA
SCHEMBL847277 0.78 POLB (0.69) USP2ALDH1A1GAAKDM4EPOLB
SCHEMBL23373383 0.78 USP2 (0.69) USP2ALDH1A1GAAPKMKDM4E
SCHEMBL4717212 0.78 USP2 (0.50) USP2ALDH1A1GAAKDM4EPOLB

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 4 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
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-20060241126-A1 Pyrimidinone Derivatives and Their Use in the Treatment of Atherosclerosis ELLIOTT RICHARD L 2006-10-26 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-20060241126-A1 Pyrimidinone Derivatives and Their Use in the Treatment of Atherosclerosis PLA2G7, PLA2G1B, PLA2G4B USP2 3518/4885ALDH1A1 505/4885GAA 604/4885

“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.