SCHEMBL17767231

SCHEMBL17767231

COc1ccc(CNC(=O)Cn2nnc3ccccc3c2=O)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR139 Q6DWJ6 11/20 0.67
▸ ALDH1A1 P00352 1/20 0.66
▸ NPSR1 Q6W5P4 1/20 0.59
▸ GAA P10253 2/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ KMT2A Q03164 3/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ HTT P42858 1/20 0.56

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
SCHEMBL17767116 0.92 GPR139 (0.59) GPR139ALDH1A1NPSR1GAAL3MBTL1
SCHEMBL17767084 0.86 GPR139 (0.82) GPR139ALDH1A1NPSR1GAAL3MBTL1
SCHEMBL17767245 0.85 GPR139 (0.68) GPR139ALDH1A1NPSR1GAAL3MBTL1
SCHEMBL17767240 0.85 GPR139 (0.71) GPR139ALDH1A1NPSR1GAAL3MBTL1
SCHEMBL17767127 0.85 GPR139 (0.63) GPR139ALDH1A1NPSR1GAAL3MBTL1
SCHEMBL17767112 0.82 GPR139 (0.81) GPR139ALDH1A1GAAL3MBTL1POLB
SCHEMBL17767162 0.82 GPR139 (0.82) GPR139ALDH1A1GAAL3MBTL1POLB
SCHEMBL17767010 0.80 GPR139 (1.00) GPR139ALDH1A1GAAL3MBTL1POLB
SCHEMBL17767008 0.80 SMN1; SMN2 (0.81) GPR139ALDH1A1GAAL3MBTL1POLB
SCHEMBL17767192 0.80 GPR139 (0.82) GPR139ALDH1A1GAAL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11173161-B2 4-oxo-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-11-16 — — US disclosed
EP-3536324-B1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINES AS MODULATORS OF GPR139 TAKEDA PHARMACEUTICALS CO (JP) 2021-10-06 — — EP disclosed
US-20200129518-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 TAKEDA CALIFORNIA, INC. 2020-04-30 — — US disclosed
US-10561662-B2 4-oxo-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-02-18 — — US disclosed
EP-3536324-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINES AS MODULATORS OF GPR139 Takeda Pharmaceutical Company Limited (JP) 2019-09-11 — — EP disclosed
EP-3221298-B1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE DERIVATIVES AS MODULATORS OF GPR139 TAKEDA PHARMACEUTICALS CO (JP) 2019-04-03 — — EP disclosed
US-20190070187-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 TAKEDA CALIFORNIA, INC. 2019-03-07 — — US disclosed
US-10159677-B2 4-OXO-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-12-25 — — US disclosed
US-20170348319-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 TAKEDA CALIFORNIA, INC. 2017-12-07 — — US disclosed
US-9770450-B2 4-OXO-3,4-dihydro-1,2,3-benzotriazine as modulators of GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-26 — — US disclosed
US-20170095480-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE AS MODULATORS OF GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (US) 2017-04-06 — — US disclosed
US-9556130-B2 4-oxo-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-01-31 — — US disclosed
US-20160145218-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 TAKEDA CALIFORNIA, INC. 2016-05-26 — — 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 (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-20190070187-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-20200129518-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-20170095480-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE AS MODULATORS OF GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1602/4885NPSR1 206/4885
US-20160145218-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-10561662-B2 4-oxo-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-10159677-B2 4-OXO-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-20170348319-A1 4-OXO-3,4-DIHYDRO-1,2,3-BENZOTRIAZINE MODULATORS OF GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885
US-11173161-B2 4-oxo-3,4-dihydro-1,2,3-benzotriazine modulators of GPR139 GPR139, GPR3, GPR84 GPR139 1/4885ALDH1A1 1826/4885NPSR1 224/4885

“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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