SCHEMBL1279680

SCHEMBL1279680

Cc1ncsc1C(C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
PKM P14618 2/20 0.50
PIK3CD O00329 1/20 0.35
P2RX7 Q99572 4/20 0.35
LMNA P02545 3/20 0.33
SLC6A3 Q01959 1/20 0.33
VHL P40337 1/20 0.33
ALDH1A1 P00352 4/20 0.32
CYP2C9 P11712 3/20 0.32
PTGS2 P35354 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
STAT1 P42224 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL27547148 0.86 KDM4E (0.47) KDM4EPKMPIK3CDP2RX7LMNA
SCHEMBL9361993 0.79 KDM4E (0.48) KDM4EPKMPIK3CDP2RX7LMNA
SCHEMBL11368864 0.79 KDM4E (0.48) KDM4EPKMP2RX7SLC6A3MEN1
Acetic Acid SCHEMBL31405463 0.78 KDM4E (0.47) KDM4EPKMPIK3CDP2RX7LMNA
Bromide SCHEMBL11363394 0.78 KDM4E (0.47) KDM4EPKMP2RX7SLC6A3MEN1
SCHEMBL10482490 0.77 KDM4E (0.46) KDM4EPKMPIK3CDP2RX7LMNA
SCHEMBL15150557 0.75
SCHEMBL6870706 0.74 KDM4E (0.39) KDM4EPKMPIK3CDP2RX7LMNA
SCHEMBL16541153 0.73 KDM4E (0.42) KDM4EPKMPIK3CDP2RX7LMNA
SCHEMBL8683323 0.73 KDM4E (0.43) KDM4EPKMPIK3CDP2RX7LMNA

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657058-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2017-05-23 US disclosed
EP-2484688-B1 PEPTIDE EPOXYKETONES FOR PROTEASOME INHIBITION ONYX THERAPEUTICS INC (US) 2016-06-08 EP disclosed
US-20150353601-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS INC (US) 2015-12-10 US disclosed
US-8765745-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2014-07-01 US disclosed
US-8735441-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2014-05-27 US disclosed
US-20140100169-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2014-04-10 US disclosed
US-20140080753-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2014-03-20 US disclosed
US-20130338057-A1 COMPOUNDS FOR ENZYME INHIBITION PROTEOLIX, INC. 2013-12-19 US disclosed
US-8609654-B1 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2013-12-17 US disclosed
US-8431571-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
EP-2484688-A1 PEPTIDE EPOXYKETONES FOR PROTEASOME INHIBITION Onyx Therapeutics, Inc. (US) 2012-08-08 EP disclosed
US-20120088762-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2012-04-12 US disclosed
US-8080576-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2011-12-20 US disclosed
US-8080545-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2011-12-20 US disclosed
US-20100144649-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2010-06-10 US disclosed
US-20100144648-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2010-06-10 US disclosed
US-7691852-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2010-04-06 US disclosed
EP-2041158-A2 PEPTIDE EPOXYKETONES FOR PROTEASOME INHIBITION Proteolix, Inc. (US) 2009-04-01 EP disclosed
WO-2007149512-A2 PEPTIDE EPOXYKETONES FOR PR0TEAS0ME INHIBITION PROTEOLIX, INC. (US) 2007-12-27 WO disclosed
US-20070293465-A1 Compounds for enzyme inhibition PROTEOLIX, INC. (US) 2007-12-20 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 (8 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-20140100169-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20120088762-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20150353601-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20140080753-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20130338057-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20070293465-A1 Compounds for enzyme inhibition PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20100144648-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885
US-20100144649-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 KDM4E 193/4885PKM 2545/4885PIK3CD 3610/4885

“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.