SCHEMBL5474090

SCHEMBL5474090

NC(=O)NC(=O)c1ccc2cc(C(F)(F)F)ccc2n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.51
▸ SCN9A Q15858 18/20 0.49
▸ SCN10A Q9Y5Y9 2/20 0.47
▸ CNR2 P34972 1/20 0.44
▸ SCN7A Q01118 2/20 0.43
▸ KCNH2 Q12809 2/20 0.43
▸ SCN5A Q14524 2/20 0.43

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
SCHEMBL27902504 0.84 BACE1 (0.58) BACE1SCN9ASCN10ACNR2SCN7A
SCHEMBL30387658 0.84 BACE1 (0.58) BACE1SCN9ASCN10ACNR2SCN7A
SCHEMBL1285735 0.79 BACE1 (0.56) BACE1SCN9ASCN10ACNR2SCN7A
SCHEMBL14597743 0.78 KDM4C (0.60) SCN9ASCN10A
Hydrochloric Acid SCHEMBL23294630 0.76 ATF4 (0.54) BACE1SCN9ASCN10ASCN7AKCNH2
SCHEMBL5471599 0.76 SCN9A (0.59) SCN9ASCN10ASCN7AKCNH2SCN5A
SCHEMBL21384521 0.75 ATF4 (0.55) BACE1SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390178 0.74 ATF4 (0.54) BACE1SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390322 0.74 ATF4 (0.48) SCN9ASCN10ASCN7AKCNH2SCN5A
SCHEMBL23333308 0.74 ATF4 (0.54) SCN9ASCN10ASCN7AKCNH2SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070004774-A1 Cept inhibitors and metabolites thereof PFIZER INC. 2007-01-04 — — US disclosed
US-20070004774-A1 Cept inhibitors and metabolites thereof PFIZER INC. 2007-01-04 — — US disclosed
US-20070004774-A1 Cept inhibitors and metabolites thereof PFIZER INC. 2007-01-04 — — 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-20070004774-A1 Cept inhibitors and metabolites thereof CETP, LCAT, MTTP BACE1 1346/4885SCN9A 4543/4885SCN10A 4663/4885

“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.

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