SCHEMBL20596151

SCHEMBL20596151

COc1ccc(-c2nccc3nc(Cc4nc5nc(Cl)ccc5[nH]4)cn23)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 7/20 0.61
▸ NOS1 P29475 6/20 0.41
▸ NOS2 P35228 6/20 0.41
▸ NOS3 P29474 4/20 0.41
▸ CYP2C9 P11712 1/20 0.37
▸ PDE2A O00408 1/20 0.34
▸ PRMT5 O14744 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33
▸ FPR2 P25090 1/20 0.33
▸ CRHR1 P34998 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
SCHEMBL30145185 1.00 MARS2 (0.61) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL20595984 0.88 MARS2 (0.75) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL23419331 0.86 MARS2 (0.44) MARS2HSP90AA1HSP90AB1CRHR1
SCHEMBL20596138 0.86 MARS2 (0.79) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL20596061 0.83 MARS2 (0.62) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL30145178 0.83 MARS2 (0.62) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL20595820 0.80 MARS2 (0.54) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL30145159 0.80 MARS2 (0.54) MARS2NOS1NOS2NOS3CYP2C9
SCHEMBL20596215 0.79 MARS2 (0.71) MARS2PRMT5CRHR1
SCHEMBL20596612 0.79 MARS2 (0.57) MARS2NOS1NOS2NOS3CYP2C9

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
US-11584744-B2 Inhibitors of type 1 methionyl-tRNA synthetase and methods of using them UNIVERSITY OF WASHINGTON (US) 2023-02-21 — — US claimed
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM UNIVERSITY OF WASHINGTON 2021-05-27 — — US claimed
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-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 12/4885NOS1 2180/4885NOS2 3487/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR MARS2 5/4885NOS1 2865/4885NOS2 3045/4885

“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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