SCHEMBL17311384

SCHEMBL17311384

COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=S)NC1c1ccc(C#N)cc1OC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 16/20 0.58
▸ TDP1 Q9NUW8 2/20 0.55
▸ HTT P42858 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ CYP2C9 P11712 3/20 0.55
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ ALOX12 P18054 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ POLB P06746 1/20 0.49
▸ MAPK1 P28482 1/20 0.49

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
SCHEMBL15793536 0.90 HTT (0.55) ELANETDP1HTTL3MBTL1CYP2C9
SCHEMBL15793304 0.90 HTT (0.55) ELANETDP1HTTL3MBTL1CYP2C9
SCHEMBL14760482 0.88 ELANE (0.70) ELANETDP1HTTL3MBTL1CYP2C9
SCHEMBL2678551 0.88 ELANE (0.70) ELANETDP1HTTL3MBTL1CYP2C9
SCHEMBL2679242 0.83 ELANE (0.71) ELANECYP2C9
SCHEMBL2678247 0.80 ELANE (0.84) ELANECYP2C9
SCHEMBL21266875 0.79 ELANE (0.83) ELANECYP2C9
SCHEMBL8344863 0.79 ELANE (0.83) ELANECYP2C9
SCHEMBL14760555 0.79 ELANE (0.83) ELANECYP2C9
SCHEMBL17311447 0.79 TDP1 (0.54) ELANETDP1HTTL3MBTL1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3154980-B1 TETRAHYDROTRIAZOLOPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES CHIESI FARM SPA (IT) 2021-08-04 — — EP disclosed
EP-3154980-B1 TETRAHYDROTRIAZOLOPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES CHIESI FARM SPA (IT) 2021-08-04 — — EP disclosed
US-9487528-B2 Compounds CHIESI FARMACEUTICI S.P.A. (IT) 2016-11-08 — — US disclosed
US-9487528-B2 Compounds CHIESI FARMACEUTICI S.P.A. (IT) 2016-11-08 — — US disclosed
US-9487528-B2 Compounds CHIESI FARMACEUTICI S.P.A. (IT) 2016-11-08 — — US disclosed
WO-2015189362-A1 TETRAHYDROTRIAZOLOPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND USES CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-17 — — WO disclosed
US-20150353561-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 — — US disclosed
US-20150353561-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 — — US disclosed
US-20150353561-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-10 — — 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-20150353561-A1 NOVEL COMPOUNDS SERPINB1, ELANE, MPO ELANE 2/4885TDP1 1812/4885HTT 1253/4885

“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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