SCHEMBL30145153

SCHEMBL30145153

COc1ccc(-c2cccc3c2CN(Cc2nc4nc(Cl)ccc4[nH]2)C3=O)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 8/20 0.49
▸ ROCK2 O75116 5/20 0.37
▸ ROCK1 Q13464 4/20 0.37
▸ FPR2 P25090 1/20 0.35
▸ IDH1 O75874 1/20 0.35
▸ CHRM5 P08912 1/20 0.34
▸ CHEK1 O14757 1/20 0.34
▸ WEE1 P30291 1/20 0.34
▸ TNIK Q9UKE5 1/20 0.34
▸ DPP4 P27487 1/20 0.34
▸ DPP8 Q6V1X1 1/20 0.34
▸ DPP9 Q86TI2 1/20 0.34
▸ MDH2 P40926 1/20 0.34

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
SCHEMBL23391438 1.00 MARS2 (0.49) MARS2ROCK2ROCK1FPR2IDH1
SCHEMBL20595909 0.89 MARS2 (0.52) MARS2FPR2
SCHEMBL30145285 0.89 MARS2 (0.52) MARS2FPR2
SCHEMBL20595883 0.86 DPP4 (0.39) MARS2ROCK2ROCK1IDH1CHEK1
SCHEMBL20596070 0.84 AMY1A (0.43) DPP4DPP8DPP9
SCHEMBL23391441 0.83 MARS2 (0.46) MARS2
SCHEMBL30145077 0.83 MARS2 (0.46) MARS2
SCHEMBL20595887 0.82 TNKS (0.36) MARS2ROCK2ROCK1IDH1TNIK
SCHEMBL23391415 0.81 DPP4 (0.36) IDH1CHRM5TNIKDPP4DPP8
SCHEMBL20595700 0.81 DPP4 (0.37) MARS2IDH1CHRM5TNIKDPP4

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 12/4885ROCK2 3865/4885ROCK1 2610/4885

“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.

Send feedback