SCHEMBL7122641

SCHEMBL7122641

CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc2c(c1)CN(C(C(=O)Nc1cc(C#N)ccc1OCc1ccccc1)c1ccccc1)C2=O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
THRB P10828 5/20 0.41
LMNA P02545 2/20 0.41
SDCBP O00560 1/20 0.39
SDC2 P34741 1/20 0.39
MAPT P10636 3/20 0.38
USP30 Q70CQ3 2/20 0.37
EGFR P00533 1/20 0.37

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
SCHEMBL7128378 0.88 GAA (0.43) GAATHRBLMNAMAPT
SCHEMBL7125640 0.83 LMNA (0.51) GAATHRBLMNASDCBPSDC2
SCHEMBL7122636 0.79 F10 (0.49) GAA
SCHEMBL7117717 0.78 MAPT (0.48) GAATHRBLMNAMAPTEGFR
SCHEMBL7126469 0.77 KDM4E (0.56) THRBLMNAMAPT
SCHEMBL7125712 0.77 THRB (0.45) GAATHRBLMNAMAPT
SCHEMBL7122643 0.75 USP30 (0.36) GAAUSP30
SCHEMBL7480433 0.71 LMNA (0.44) LMNAMAPT
SCHEMBL7121933 0.69 HPGD (0.44) LMNAMAPT
SCHEMBL7129110 0.69 F10 (0.59)

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-20030114448-A1 Inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. 2003-06-19 US disclosed
WO-2002096873-A1 ISOINDOLE AND ISOQUINOLINE DERIVATIVES AS INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2002-12-05 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-20030114448-A1 Inhibitors of factor Xa SERPINC1, F11, TFPI GAA 395/4885THRB 3047/4885LMNA 388/4885

“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.