SCHEMBL20595969

SCHEMBL20595969

COc1ccc(-c2nn(C)c3c2CN(Cc2nc4nc(Cl)ccc4[nH]2)CC3)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 4/20 0.43
▸ ACHE P22303 1/20 0.38
▸ CREBBP Q92793 2/20 0.37
▸ CRHR1 P34998 2/20 0.37
▸ HDAC1 Q13547 2/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.34
▸ CLPP Q16740 2/20 0.34
▸ BRS3 P32247 1/20 0.34
▸ DRD4 P21917 4/20 0.33
▸ DRD2 P14416 3/20 0.33
▸ DRD3 P35462 2/20 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
SCHEMBL30145209 1.00 MARS2 (0.43) MARS2ACHECREBBPCRHR1HDAC1
SCHEMBL30145155 0.87 MARS2 (0.43) MARS2ACHECRHR1HDAC1HDAC6
SCHEMBL20595933 0.87 MARS2 (0.43) MARS2ACHECRHR1HDAC1HDAC6
SCHEMBL20595993 0.83 MARS2 (0.52) MARS2ACHEHDAC1HDAC6CLPP
SCHEMBL30145073 0.83 MARS2 (0.52) MARS2ACHEHDAC1HDAC6CLPP
SCHEMBL20595863 0.82 MARS2 (0.44) MARS2ACHEDRD4DRD2DRD3
SCHEMBL30145203 0.82 MARS2 (0.44) MARS2ACHEDRD4DRD2DRD3
SCHEMBL20595906 0.81 MARS2 (0.46) MARS2ACHECLPPDRD4DRD2
SCHEMBL30145186 0.81 MARS2 (0.46) MARS2ACHECLPPDRD4DRD2
SCHEMBL20596106 0.77 MARS2 (0.45) MARS2ACHEDRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 12/4885ACHE 4482/4885CREBBP 1939/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR MARS2 5/4885ACHE 4249/4885CREBBP 1985/4885

“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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