SCHEMBL6498107

SCHEMBL6498107

COC(=O)C1=C(c2ccc(C(F)(F)F)cc2)CCC1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 10/20 0.70
▸ SLC6A3 Q01959 16/20 0.67
▸ SLC6A4 P31645 1/20 0.61
▸ PTGS2 P35354 2/20 0.51
▸ PTGS1 P23219 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
SCHEMBL6499457 0.96 SLC6A2 (0.77) SLC6A2SLC6A3SLC6A4PTGS2
SCHEMBL6499702 0.81 SLC6A3 (0.74) SLC6A2SLC6A3SLC6A4
SCHEMBL6498616 0.81 PTGS2 (0.53) SLC6A2SLC6A3SLC6A4PTGS2PTGS1
SCHEMBL6503781 0.81 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4PTGS2
SCHEMBL6503784 0.81 SLC6A2 (0.56) SLC6A2SLC6A3SLC6A4PTGS2
SCHEMBL21335107 0.80 SLC6A3 (1.00) SLC6A2SLC6A3SLC6A4
SCHEMBL6999838 0.80 SLC6A3 (0.85) SLC6A2SLC6A3SLC6A4
SCHEMBL6488184 0.78 SLC6A2 (0.52) SLC6A2SLC6A3SLC6A4PTGS2PTGS1
SCHEMBL6489462 0.78 SLC6A2 (0.52) SLC6A2SLC6A3SLC6A4PTGS2PTGS1
SCHEMBL6492770 0.78 SLC6A2 (0.52) SLC6A2SLC6A3SLC6A4PTGS2PTGS1

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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 — — US disclosed
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 — — EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 — — 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 SLC6A2 1801/4885SLC6A3 3942/4885SLC6A4 3899/4885

“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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