SCHEMBL6491779

SCHEMBL6491779

CC(=O)NCCN1CCc2cc(NC(=O)C3=C(c4ccc(C(F)(F)F)cc4)CCCC3)ccc2C1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 1/20 0.43
▸ EPHX2 P34913 7/20 0.43
▸ CHRNB2 P17787 1/20 0.43
▸ CHRNB4 P30926 1/20 0.43
▸ CHRNA3 P32297 1/20 0.43
▸ CHRNA4 P43681 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ ITGB3 P05106 1/20 0.40
▸ ITGA2B P08514 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ APOB P04114 1/20 0.40
▸ MTTP P55157 1/20 0.40
▸ CD274 Q9NZQ7 1/20 0.39
▸ PTGES O14684 1/20 0.39

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
SCHEMBL6492509 0.90 PLAU (0.47) MEN1KMT2ATP53ALOX15ITGB3
SCHEMBL6501693 0.89 MEN1 (0.54) MEN1KMT2ATP53ALOX15ITGB3
SCHEMBL6489620 0.85 ABCB1 (0.51) —
SCHEMBL691418 0.84 MTTP (0.59) APOBMTTP
Hydrochloric Acid SCHEMBL8408661 0.83 MTTP (0.59) APOBMTTP
Hydrochloric Acid SCHEMBL3887925 0.83 MTTP (0.59) APOBMTTP
Hydrochloric Acid SCHEMBL8410108 0.83 MTTP (0.58) APOBMTTP
SCHEMBL6496773 0.82 ABCB1 (0.40) ACACBITGB3ITGA2BAPOBMTTP
SCHEMBL6498905 0.82 ABCB1 (0.42) ITGB3ITGA2BAPOBMTTP
SCHEMBL6489158 0.81 SMO (0.46) APOBMTTP

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 ACACB 108/4885EPHX2 864/4885CHRNB2 767/4885

“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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