SCHEMBL20595883

SCHEMBL20595883

COc1ccc(-c2cccc3c2CN(Cc2nc4cc(Cl)ccc4[nH]2)C3=O)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.39
▸ DPP8 Q6V1X1 3/20 0.39
▸ DPP9 Q86TI2 3/20 0.39
▸ DRD4 P21917 4/20 0.38
▸ CXCR2 P25025 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ CYP2C19 P33261 1/20 0.36
▸ PDE10A Q9Y233 1/20 0.36
▸ CHEK1 O14757 1/20 0.36
▸ WEE1 P30291 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ MARS2 Q96GW9 1/20 0.35
▸ AMY1A P0DUB6 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL20596070 0.93 AMY1A (0.43) DPP4DPP8DPP9DRD4CXCR2
SCHEMBL30145153 0.86 MARS2 (0.49) DPP4DPP8DPP9CHEK1WEE1
SCHEMBL23391438 0.86 MARS2 (0.49) DPP4DPP8DPP9CHEK1WEE1
SCHEMBL20595887 0.82 TNKS (0.36) DPP4DPP8DPP9TNIKMARS2
SCHEMBL20595825 0.81 HPGD (0.33) DPP4DPP8DPP9CYP3A4PDE10A
SCHEMBL23391546 0.79 IDH1 (0.37) DPP4DPP8DPP9CYP3A4CYP2C19
SCHEMBL23391415 0.78 DPP4 (0.36) DPP4DPP8DPP9CYP3A4CYP2C19
SCHEMBL20595700 0.78 DPP4 (0.37) DPP4DPP8DPP9CYP3A4CYP2C19
SCHEMBL23391457 0.76 HSP90AA1 (0.36) DPP4DPP8DPP9CYP3A4CYP2C19
SCHEMBL30145116 0.76 HSP90AA1 (0.36) DPP4DPP8DPP9CYP3A4CYP2C19

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 5 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 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 DPP4 1345/4885DPP8 804/4885DPP9 842/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR DPP4 1248/4885DPP8 780/4885DPP9 769/4885

“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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