SCHEMBL30145087

SCHEMBL30145087

COc1ccc(-c2cnn3c2CN(Cc2nc4nc(Cl)ccc4[nH]2)CC3)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MARS2 Q96GW9 6/20 0.45
▸ DRD4 P21917 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MCHR1 Q99705 1/20 0.33
▸ ROCK2 O75116 3/20 0.33
▸ ACHE P22303 1/20 0.33
▸ PRMT5 O14744 1/20 0.32
▸ HRH4 Q9H3N8 2/20 0.32
▸ CCR2 P41597 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ ABCB1 P08183 1/20 0.32
▸ NOS3 P29474 1/20 0.32
▸ NOS1 P29475 1/20 0.32
▸ NOS2 P35228 1/20 0.32

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
SCHEMBL20596106 1.00 MARS2 (0.45) MARS2DRD4ALDH1A1LMNAMAPT
SCHEMBL30145270 0.92 MARS2 (0.46) MARS2DRD4ALDH1A1LMNAMAPT
SCHEMBL20596033 0.92 MARS2 (0.46) MARS2DRD4ALDH1A1LMNAMAPT
SCHEMBL20595888 0.89 MARS2 (0.47) MARS2DRD4ALDH1A1LMNAMAPT
SCHEMBL30145146 0.89 MARS2 (0.47) MARS2DRD4ALDH1A1LMNAMAPT
SCHEMBL20595863 0.79 MARS2 (0.44) MARS2DRD4ACHEPRMT5
SCHEMBL30145203 0.79 MARS2 (0.44) MARS2DRD4ACHEPRMT5
SCHEMBL20595993 0.78 MARS2 (0.52) MARS2DRD4ACHE
SCHEMBL30145073 0.78 MARS2 (0.52) MARS2DRD4ACHE
SCHEMBL20595969 0.77 MARS2 (0.43) MARS2DRD4ACHE

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 12/4885DRD4 4438/4885ALDH1A1 1461/4885

“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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