SCHEMBL17513615

SCHEMBL17513615

O=C(O)CC1CCCN(Cc2cc(Cl)cc(Cl)c2)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.54
CYP2D6 P10635 1/20 0.47
GAA P10253 1/20 0.47
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
BCHE P06276 3/20 0.46
ACHE P22303 2/20 0.46
MAOB P27338 1/20 0.46
KAT2B Q92831 1/20 0.44
KDM4E B2RXH2 2/20 0.44
CCR2 P41597 1/20 0.43
KCNH2 Q12809 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL8697094 0.85 LTA4H (0.66) LTA4HCYP2D6BCHEACHEMAOB
SCHEMBL19378007 0.83 KDM4E (0.54) LTA4HGAABCHEACHEMAOB
SCHEMBL7695896 0.76 LTA4H (0.65) LTA4HGAABCHEACHEALDH1A1
SCHEMBL31191656 0.75 BCHE (0.59) LTA4HCYP2D6BCHEACHEMAOB
SCHEMBL24976713 0.74 S1PR5 (0.59) LTA4HGAA
SCHEMBL8409280 0.74 CYP2D6 (0.55) LTA4HCYP2D6GAABCHEALDH1A1
SCHEMBL10079679 0.74 CYP2D6 (0.42) LTA4HCYP2D6GAABCHEACHE
SCHEMBL19850979 0.74 KAT2B (0.49) GAAKAT2BKDM4EALDH1A1
SCHEMBL17513569 0.74 KAT2B (0.45) GAABCHEKAT2BKDM4EALDH1A1
SCHEMBL17062088 0.73 SCN7A (0.44) LTA4HALDH1A1MEN1KMT2A

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
WO-2016029146-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON (US) 2016-02-25 WO claimed
US-10913736-B2 Specific inhibitors of methionyl-tRNA synthetase UNIVERSITY OF WASHINGTON (US) 2021-02-09 US disclosed
US-10913736-B2 Specific inhibitors of methionyl-tRNA synthetase UNIVERSITY OF WASHINGTON (US) 2021-02-09 US disclosed
US-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON 2017-09-28 US disclosed
US-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON 2017-09-28 US disclosed
US-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON 2017-09-28 US disclosed
WO-2016029146-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON (US) 2016-02-25 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-20170275279-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE AARS1, MTR, GARS1 LTA4H 2889/4885CYP2D6 3206/4885GAA 671/4885
US-10913736-B2 Specific inhibitors of methionyl-tRNA synthetase AARS1, MTR, GARS1 LTA4H 2889/4885CYP2D6 3206/4885GAA 671/4885

“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.