SCHEMBL20595889

SCHEMBL20595889

CC(C)(N)Cn1c(Cc2ccc(Cl)cc2Cl)cn(Cc2nc3nc(Cl)ccc3[nH]2)c1=O

nearest known ligand 0.79

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MARS2 Q96GW9 9/20 0.79
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL20596174 0.92 MARS2 (0.79) MARS2TSHRHTTSMN1; SMN2CYP1A2
SCHEMBL20595832 0.90 MARS2 (0.81) MARS2
SCHEMBL20596040 0.89 MARS2 (1.00) MARS2TSHRSMN1; SMN2CYP1A2CYP3A4
SCHEMBL20596139 0.87 MARS2 (0.72) MARS2SMN1; SMN2
SCHEMBL20595884 0.87 MARS2 (0.86) MARS2TSHR
SCHEMBL20596052 0.87 MARS2 (0.80) MARS2TSHRHTTSMN1; SMN2
SCHEMBL20595917 0.85 MARS2 (0.80) MARS2TSHRHTT
SCHEMBL20596018 0.84 MARS2 (1.00) MARS2TSHR
SCHEMBL20595966 0.83 MARS2 (0.77) MARS2SMN1; SMN2CYP3A4CYP2C9CYP2C19
SCHEMBL20595904 0.82 MARS2 (0.75) MARS2HTT

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 2 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 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 (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-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR MARS2 5/4885TSHR 1053/4885HTT 1309/4885

“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.