SCHEMBL2540286

SCHEMBL2540286

O=C(Nc1nc2ccc(Sc3nnc4ccc(-c5cn[nH]c5)cn34)cc2s1)C1CC1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.60
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
USP30 Q70CQ3 2/20 0.49
ABL1 P00519 4/20 0.48
LCK P06239 4/20 0.47
ITK Q08881 4/20 0.47
MAP4K1 Q92918 5/20 0.46
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44

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
SCHEMBL1839889 0.87 MET (0.51) METUSP30ABL1LCKITK
SCHEMBL2540564 0.87 MET (0.73) METABL1MAP4K1CASP3SENP8
SCHEMBL2534661 0.86 MET (0.59) METPDE3BPDE3A
SCHEMBL2541449 0.85 MET (0.66) METABL1CASP3SENP8SENP7
SCHEMBL2542908 0.84 MET (0.63) METABL1LCKCASP3SENP8
SCHEMBL2540905 0.83 MET (0.59) METPDE3BPDE3A
SCHEMBL2539335 0.83 MET (0.54) METPDE3BPDE3AABL1
Hydrochloric Acid SCHEMBL2543903 0.83 MET (0.54) METPDE3BPDE3AABL1
SCHEMBL2534684 0.79 MET (0.60) METABL1LCKCASP3SENP8
SCHEMBL2539470 0.79 MET (0.60) METPDE3BPDE3A

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-20110263594-A1 NOVEL TRIAZOLO(4,3-A)PYRIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE, IN PARTICULAR AS MET INHIBITORS SANOFI-AVENTIS (FR) 2011-10-27 US 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-20110263594-A1 NOVEL TRIAZOLO(4,3-A)PYRIDINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, USE THEREOF AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS AND NOVEL USE, IN PARTICULAR AS MET INHIBITORS MET, RET, ALK MET 1/4885PDE3B 2177/4885PDE3A 2437/4885

“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.