SCHEMBL20595673

SCHEMBL20595673

N=C(N)SCc1ccccn1

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.96
IDO1 P14902 6/20 0.55
NOS1 P29475 2/20 0.55
NOS3 P29474 1/20 0.55
NOS2 P35228 1/20 0.55
HRH1 P35367 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPT P10636 2/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
CYP1A2 P05177 2/20 0.47
TSHR P16473 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HTT P42858 3/20 0.47
TAAR1 Q96RJ0 2/20 0.47
SLC11A2 P49281 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HPGD P15428 2/20 0.45
TP53 P04637 2/20 0.45

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
Hydrochloric Acid SCHEMBL1770126 0.98 LMNA (1.00) LMNAIDO1NOS1NOS3NOS2
Bromide SCHEMBL23391499 0.98 LMNA (0.93) LMNAIDO1NOS1NOS3NOS2
Bromide SCHEMBL30145206 0.98 LMNA (0.93) LMNAIDO1NOS1NOS3NOS2
SCHEMBL14970178 0.82 LMNA (0.68) LMNAIDO1NOS1NOS3NOS2
SCHEMBL2813631 0.79 LMNA (0.62) LMNAIDO1NOS1NOS3NOS2
SCHEMBL11468101 0.77 LMNA (0.61) LMNAHRH1ALDH1A1MAPTCRHBP
SCHEMBL11830097 0.77 LMNA (0.61) LMNAHRH1ALDH1A1MAPTCRHBP
Bromide SCHEMBL2811541 0.77 LMNA (0.61) LMNAIDO1NOS1NOS3NOS2
Hydrochloric Acid SCHEMBL10705434 0.76 LMNA (0.64) LMNAHRH1ALDH1A1MAPTCRHBP
SCHEMBL28112101 0.76 LMNA (0.59) LMNAHRH1ALDH1A1MAPTCRHBP

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 LMNA 3342/4885IDO1 1989/4885NOS1 2180/4885
US-20210155617-A1 INHIBITORS OF TYPE l METHIONYL-TRNA SYNTHETASE AND METHODS OF USING THEM AARS1, GARS1, MTR LMNA 2770/4885IDO1 2633/4885NOS1 2865/4885

“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.