SCHEMBL16590409

SCHEMBL16590409

Cc1ccc(C(=O)N=C=O)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CPS1 P31327 2/20 0.39
▸ CSNK2A1 P68400 1/20 0.38
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ PDK2 Q15119 2/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.34
▸ SLC9A1 P19634 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ F2 P00734 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAU P00749 1/20 0.33
▸ PLAT P00750 1/20 0.33
▸ MAP2K2 P36507 1/20 0.33

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
SCHEMBL5314369 0.82 CES2 (0.57) CES2CES1ALDH1A1KDM4EMAPT
SCHEMBL11286933 0.82 MEN1 (0.46) CSNK2A1HDAC7LMNATSHRMEN1
SCHEMBL18714113 0.80 CSNK2A1 (0.41) CPS1CSNK2A1LOXL2CES2CES1
SCHEMBL15539727 0.79 MAP2K1 (0.39) CES2CES1MAP2K2MAP2K1
SCHEMBL8348114 0.79 TRPA1 (0.42) CES2CES1LMNATSHRKMT2A
SCHEMBL28754538 0.79 CPS1 (0.54) CPS1LMNAMEN1KMT2AALDH1A1
SCHEMBL19121284 0.77 CSNK2A1 (0.39) CPS1CSNK2A1LOXL2CES2CES1
SCHEMBL15541210 0.77 GAA (0.48) CES2ALDH1A1KDM4EHPGDHTT
SCHEMBL9726681 0.75 CSNK2A1 (0.47) CPS1CSNK2A1LOXL2CES2CES1
SCHEMBL4145212 0.74 CES2 (0.54) CES2CES1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160339000-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS Ichnos Sciences SA (CH) 2016-11-24 — — US disclosed
US-9439890-B2 Triazolone compounds as mPGES-1 inhibitors GLENMARK PHARMACEUTICALS S.A. (CH) 2016-09-13 — — US disclosed
US-20150283117-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS Ichnos Sciences SA (CH) 2015-10-08 — — US disclosed
US-9096545-B2 Triazolone compounds as mPGES-1 inhibitors GLENMARK PHARMACEUTICALS S.A. (CH) 2015-08-04 — — US disclosed
US-20150087646-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2015-03-26 — — 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 (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-20150283117-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS PTGES, PTGIS, PTGS1 CPS1 3956/4885CSNK2A1 2630/4885LOXL2 1681/4885
US-20160339000-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS PTGES, PTGS1, PTGIS CPS1 3344/4885CSNK2A1 1965/4885LOXL2 1599/4885
US-20150087646-A1 TRIAZOLONE COMPOUNDS AS mPGES-1 INHIBITORS PTGES, PTGS1, PTGIS CPS1 3344/4885CSNK2A1 1965/4885LOXL2 1599/4885

“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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