SCHEMBL4988232

SCHEMBL4988232

NC(COCc1ccccc1Cl)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 11/20 0.59
IDO1 P14902 2/20 0.52
SCN4A P35499 7/20 0.50
CACNA1F O60840 1/20 0.48
CACNA1D Q01668 1/20 0.48
CACNA1S Q13698 1/20 0.48
CACNA1C Q13936 1/20 0.48

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
SCHEMBL7964814 0.83 IDO1 (0.52) TACR1IDO1
SCHEMBL7964819 0.83 IDO1 (0.52) TACR1IDO1
SCHEMBL4981770 0.79 TACR1 (0.59) TACR1SCN4ACACNA1FCACNA1DCACNA1S
SCHEMBL25183077 0.79 SLC1A5 (0.53) IDO1
SCHEMBL25183076 0.79 SLC1A5 (0.53) IDO1
SCHEMBL3282691 0.78 PNMT (0.48) IDO1SCN4A
SCHEMBL7312106 0.78 IDO1 (0.50) IDO1
Hydrochloric Acid SCHEMBL7312436 0.77 IDO1 (0.51) IDO1
SCHEMBL3774965 0.77 IDO1 (0.67) IDO1
SCHEMBL2782707 0.77 SCN4A (0.68) TACR1SCN4ACACNA1FCACNA1DCACNA1S

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 TACR1 814/4885IDO1 3133/4885SCN4A 3286/4885
US-20070093525-A1 Triamide-substituted heterobicyclic compounds APOB, MTPN, CTRB1 TACR1 814/4885IDO1 3133/4885SCN4A 3286/4885

“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.