SCHEMBL20595847

SCHEMBL20595847

COc1ccc(Cc2cn(Cc3nc4c(C)c(Cl)ccc4[nH]3)c(=O)n2CC(C)(C)O)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 7/20 0.61
▸ HCRTR1 O43613 10/20 0.36
▸ HCRTR2 O43614 10/20 0.36
▸ PDE2A O00408 1/20 0.32
▸ OPRM1 P35372 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ OPRK1 P41145 1/20 0.31

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
SCHEMBL23419588 0.94 MARS2 (0.61) MARS2HCRTR1HCRTR2PDE2AOPRM1
SCHEMBL20595818 0.90 MARS2 (0.57) MARS2HCRTR1HCRTR2
SCHEMBL20595827 0.87 MARS2 (0.81) MARS2OPRM1OPRD1OPRK1
SCHEMBL20596266 0.84 MARS2 (0.55) MARS2PDE2A
SCHEMBL20595946 0.84 MARS2 (0.57) MARS2
SCHEMBL20595926 0.81 MARS2 (0.52) MARS2
SCHEMBL20595832 0.79 MARS2 (0.81) MARS2OPRM1OPRD1OPRK1
SCHEMBL23419455 0.78 MARS2 (0.64) MARS2HCRTR1HCRTR2OPRM1OPRD1
SCHEMBL20595845 0.77 MARS2 (0.74) MARS2
SCHEMBL20596174 0.77 MARS2 (0.79) MARS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018237349-A1 INHIBITORS OF TYPED 1 METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON (US) 2018-12-27 — — WO claimed
US-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them UNIVERSITY OF WASHINGTON (US) 2023-02-21 — — US disclosed
US-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them UNIVERSITY OF WASHINGTON (US) 2023-02-21 — — US disclosed
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON 2021-05-27 — — US disclosed
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON 2021-05-27 — — US disclosed
WO-2018237349-A1 INHIBITORS OF TYPED 1 METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON (US) 2018-12-27 — — WO 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 (2 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-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them AARS1, EMG1, GARS1 MARS2 12/4885HCRTR1 3836/4885HCRTR2 4630/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR MARS2 5/4885HCRTR1 3976/4885HCRTR2 4447/4885

“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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