SCHEMBL6497655

SCHEMBL6497655

O=C(Nc1ccc2c(c1)CNC2)C1=C(c2ccc(Br)cc2)CCCC1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 1/20 0.50
▸ DHODH Q02127 1/20 0.46
▸ SLC2A1 P11166 1/20 0.45

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
SCHEMBL30182702 0.78 MELK (0.69) MELKSLC2A1
SCHEMBL6487719 0.78 MELK (0.51) MELKSLC2A1
SCHEMBL6497815 0.71 NAMPT (0.44) DHODH
SCHEMBL12501320 0.68 ITGB3 (0.58) —
SCHEMBL531914 0.68 NPC1 (0.66) MELKSLC2A1
SCHEMBL29606520 0.67 ITGB3 (0.54) —
SCHEMBL531907 0.67 CYP1A2 (0.55) —
SCHEMBL24669402 0.67 SLC2A1 (0.61) MELKSLC2A1
SCHEMBL29803671 0.67 SLC2A1 (0.61) MELKSLC2A1
SCHEMBL2333229 0.67 ITGB3 (0.60) —

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 2764/4885DHODH 4355/4885SLC2A1 1022/4885

“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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