SCHEMBL4985141

SCHEMBL4985141

CS(=O)(=O)NCC(N)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.67
KEAP1 Q14145 1/20 0.44
GRIA4 P48058 2/20 0.43
POLB P06746 1/20 0.43
PER2 O15055 1/20 0.42
CRY1 Q16526 1/20 0.42
CRY2 Q49AN0 1/20 0.42
AOC3 Q16853 1/20 0.40
SCN4A P35499 1/20 0.39

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
SCHEMBL4982155 0.84 GBA1 (0.65) GBA1GRIA4
SCHEMBL5188431 0.82 POLB (0.47) GBA1KEAP1GRIA4POLBPER2
SCHEMBL390242 0.82 GBA1 (0.46) GBA1GRIA4POLB
SCHEMBL4986251 0.80 GBA1 (1.00) GBA1KEAP1
SCHEMBL4984120 0.80 GBA1 (0.59) GBA1GRIA4AOC3
SCHEMBL3432045 0.78 KDM4E (0.57) PER2CRY1CRY2AOC3
SCHEMBL17793729 0.78 GRIA4 (0.47) GBA1KEAP1GRIA4POLBPER2
SCHEMBL1714980 0.77 GBA1 (0.41) GBA1KEAP1GRIA4POLBPER2
SCHEMBL12879312 0.77 GBA1 (0.79) GBA1
SCHEMBL4986451 0.77 GBA1 (0.79) GBA1

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-7393958-B2 Triamide-substituted heterobicyclic compounds PFIZER, INC. (US) 2008-07-01 US disclosed
US-7368573-B2 Triamide-substituted heterobicyclic compounds PFIZER INC. (US) 2008-05-06 US disclosed
US-20070093525-A1 Triamide-substituted heterobicyclic compounds PFIZER INC 2007-04-26 US disclosed
US-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS BERTINATO PETER 2006-10-05 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-20060223851-A1 TRIAMIDE-SUBSTITUTED HETEROBICYCLIC COMPOUNDS APOB, MTPN, CTRB1 GBA1 426/4885KEAP1 3377/4885GRIA4 4068/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 GBA1 426/4885KEAP1 3377/4885GRIA4 4068/4885

“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.