SCHEMBL1787742

SCHEMBL1787742

Cc1ccc(SS)c(-c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC7 Q8WUI4 1/20 0.44
PSMB5 P28074 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
MAOB P27338 2/20 0.39
ELANE P08246 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
TSHR P16473 2/20 0.37
ACHE P22303 2/20 0.37
ALOX12 P18054 1/20 0.37
HPGD P15428 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL575883 0.84 HDAC7 (0.46) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL576376 0.84 HDAC7 (0.46) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL9914232 0.82 HDAC7 (0.45) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL13750090 0.79 HTR1A (0.47) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL28223280 0.79 PTGDR2 (0.44) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL25811691 0.78 MAPT (0.43) HDAC7PSMB5PTGDR2KDM4EALDH1A1
SCHEMBL1784382 0.77 MAPT (0.43) PSMB5ALDH1A1L3MBTL1LMNAMAPT
SCHEMBL16678768 0.75 ACHE (0.50) MAOBALDH1A1LMNAMAPTTSHR
SCHEMBL3005820 0.74 ELANE (0.52) HDAC7PSMB5PTGDR2MAOBELANE
SCHEMBL6893252 0.74 HTR7 (0.47) KDM4EALDH1A1LMNAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323975-B1 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES SI GROUP INC (US) 2019-04-24 EP disclosed
US-9796939-B2 Multi-ring antioxidants with antiwear properties SI GROUP, INC. (US) 2017-10-24 US disclosed
US-20140038871-A1 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES ALBEMARLE CORPORATION (US) 2014-02-06 US disclosed
US-8580718-B2 Multi-ring antioxidants with antiwear properties ALBERMARLE CORPORATION (US) 2013-11-12 US disclosed
US-20110124540-A1 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES ALBEMARLE CORPORATION (US) 2011-05-26 US disclosed
EP-2323975-A2 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES Albemarle Corporation (US) 2011-05-25 EP disclosed
WO-2010011523-A2 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES ALBEMARLE CORPORATION (US) 2010-01-28 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-20110124540-A1 MULTI-RING ANTIOXIDANTS WITH ANTIWEAR PROPERTIES GSR, CBR1, SOD1 HDAC7 4150/4885PSMB5 2779/4885PTGDR2 2935/4885

“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.