SCHEMBL6437835

SCHEMBL6437835

COc1ccccc1CN(CC(=O)OC(=O)C(F)(F)F)S(=O)(=O)c1ccc2c(Cl)cnc(NC(=N)N)c2c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLAU P00749 5/20 0.42
TP53 P04637 1/20 0.39
KMT2A Q03164 2/20 0.37
TAS2R14 Q9NYV8 5/20 0.37
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.35
THRB P10828 1/20 0.35
BDKRB1 P46663 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PLG P00747 1/20 0.34

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
SCHEMBL6432842 0.91 PLAU (0.43) PLAUKMT2ATAS2R14MAPTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL6437834 0.90 PLAU (0.50) PLAUTP53KMT2ATAS2R14MAPT
Trifluoroacetic Acid SCHEMBL6433618 0.90 PLAU (0.42) PLAUTP53KMT2ATAS2R14MAPT
SCHEMBL6435148 0.88 PLAU (0.55) PLAUKMT2AMAPTSMN1; SMN2ALDH1A1
Trifluoroacetic Acid SCHEMBL7451293 0.87 PLAU (0.40) PLAUTP53KMT2ATAS2R14MAPT
SCHEMBL6434442 0.85 PLAU (0.49) PLAUTAS2R14MAPTSMN1; SMN2LMNA
SCHEMBL6437292 0.82 PLAU (0.53) PLAUTP53KMT2AMAPTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL6432841 0.80 PLAU (0.52) PLAUKMT2ATAS2R14MAPTSMN1; SMN2
SCHEMBL6436490 0.80 PLAU (0.44) PLAUTAS2R14MAPTSMN1; SMN2ALDH1A1
SCHEMBL7371684 0.79 ALDH1A1 (0.37) TP53KMT2ATAS2R14MAPTSMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026836-A1 Composition for the treatment of damaged tissue DACK KEVIN NEIL (GB) 2005-02-03 US disclosed
US-20030199440-A1 Composition for the treatment of damaged tissue PFIZER INC. 2003-10-23 US disclosed
EP-1077945-B1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER (US) 2003-01-08 EP disclosed
US-6093731-A Isoquinolines PFIZER INC. 2000-07-25 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 (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-20030199440-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 PLAU 119/4885TP53 298/4885KMT2A 4810/4885
US-20050026836-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 PLAU 119/4885TP53 298/4885KMT2A 4810/4885

“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.