SCHEMBL1619764

SCHEMBL1619764

COc1cc(OC)c(F)c(C(Nc2ccc(C#N)cc2)C(=N)SC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MCL1 Q07820 1/20 0.39
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
F10 P00742 1/20 0.33
GSK3B P49841 1/20 0.33
MMP2 P08253 1/20 0.33
F7 P08709 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 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
SCHEMBL2872170 0.89 MEN1 (0.35) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL13998927 0.86 F7 (0.39) ALDH1A1MAPTF10F7MAPK1
SCHEMBL5883488 0.85 MEN1 (0.42) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL1618513 0.84 MEN1 (0.37) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL1621026 0.80 ALDH1A1 (0.47) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL1619763 0.77 MEN1 (0.36) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL3464005 0.75 F10 (0.43) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL13162156 0.74 CA12 (0.38) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL2701454 0.74 MEN1 (0.33) MEN1KMT2AMCL1FPR1FPR2
SCHEMBL2597368 0.74 KCNH2 (0.35) MEN1KMT2AMCL1FPR1FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2194046-B1 Triazolone derivative EISAI R&D MAN CO LTD (JP) 2012-05-09 EP disclosed
US-8163787-B2 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-24 US disclosed
US-8163787-B2 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-04-24 US disclosed
US-20110112109-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2011-05-12 US disclosed
US-20110112109-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2011-05-12 US disclosed
US-7928228-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2011-04-19 US disclosed
US-7928228-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2011-04-19 US disclosed
US-7816522-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2010-10-19 US disclosed
US-7816522-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2010-10-19 US disclosed
US-7816522-B2 Triazolone derivatives EISAI CO., LTD. (JP) 2010-10-19 US disclosed
US-20100190783-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2010-07-29 US disclosed
US-20100190783-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2010-07-29 US disclosed
US-20100190783-A1 TRIAZOLONE DERIVATIVES CLARK RICHARD 2010-07-29 US disclosed
EP-2194046-A1 Triazolone derivative Eisai R&D Management Co., Ltd. (JP) 2010-06-09 EP disclosed
EP-2000465-A1 TRIAZOLONE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2008-12-10 EP disclosed
US-20080015199-A1 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-01-17 US disclosed
US-20080015199-A1 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-01-17 US disclosed
US-20080015199-A1 Triazolone derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-01-17 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 (3 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-20100190783-A1 TRIAZOLONE DERIVATIVES H1-0, H1-10, H1-2 MEN1 159/4885KMT2A 948/4885MCL1 1219/4885
US-20110112109-A1 TRIAZOLONE DERIVATIVES H1-10, H1-0, H1-2 MEN1 243/4885KMT2A 1010/4885MCL1 1472/4885
US-20080015199-A1 Triazolone derivatives F3, F12, F2 MEN1 335/4885KMT2A 1639/4885MCL1 538/4885

“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.