SCHEMBL6487719

SCHEMBL6487719

O=C(Nc1ccc2c(c1)CCNC2)C1=C(c2ccc(C(F)(F)F)cc2)CCCC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 4/20 0.51
▸ SLC2A1 P11166 2/20 0.50
▸ F2 P00734 1/20 0.47
▸ PLG P00747 1/20 0.47
▸ PLAU P00749 1/20 0.47
▸ PLAT P00750 1/20 0.47
▸ KLKB1 P03952 1/20 0.47
▸ PRSS1 P07477 1/20 0.47
▸ ASIC3 Q9UHC3 1/20 0.46
▸ APOB P04114 1/20 0.41
▸ MTTP P55157 1/20 0.41
▸ SNCA P37840 1/20 0.41
▸ USP28 Q96RU2 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL8208303 0.80 APOB (0.62) MELKSLC2A1ASIC3APOBMTTP
Hydrochloric Acid SCHEMBL1187215 0.80 EPHX2 (0.55) MELKSLC2A1F2PLGPLAU
SCHEMBL6677499 0.79 NPC1 (0.50) TRPV1
SCHEMBL6497655 0.78 MELK (0.50) MELKSLC2A1
SCHEMBL6496056 0.77 MAPKAPK2 (0.66) —
SCHEMBL6498482 0.75 APOB (0.69) APOBMTTP
SCHEMBL6678240 0.75 SLC6A2 (0.45) SNCATRPV1
SCHEMBL14585871 0.75 APOB (0.56) MELKAPOBMTTP
SCHEMBL13504912 0.75 MELK (0.49) MELKSLC2A1F2PLGPLAU
Hydrochloric Acid SCHEMBL3616292 0.75 SLC2A1 (0.50) MELKSLC2A1F2PLGPLAU

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 MELK 2764/4885SLC2A1 1022/4885F2 62/4885

“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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