SCHEMBL6496773

SCHEMBL6496773

O=C(O)Nc1cccc(CCN2CCc3cc(NC(=O)C4=C(c5ccc(C(F)(F)F)cc5)CCCC4)ccc3C2)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 8/20 0.40
ABCG2 Q9UNQ0 7/20 0.40
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
ACACB O00763 1/20 0.38
TNF P01375 1/20 0.38
NOD1 Q9Y239 1/20 0.38
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
MTTP P55157 2/20 0.37
APOB P04114 1/20 0.37
SMO Q99835 1/20 0.37

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
SCHEMBL6498905 0.91 ABCB1 (0.42) ABCB1ABCG2ITGB3ITGA2BPRMT5
SCHEMBL6487457 0.90 DRD2 (0.47) ABCB1ABCG2ACACBTNFNOD1
SCHEMBL6489158 0.88 SMO (0.46) ABCB1ABCG2PRMT5WDR77MTTP
SCHEMBL6489620 0.86 ABCB1 (0.51) ABCB1ABCG2TNFNOD1
SCHEMBL6491779 0.82 ACACB (0.43) ITGB3ITGA2BACACBMTTPAPOB
SCHEMBL6501845 0.80 NOD1 (0.47) ACACBTNFNOD1
SCHEMBL6491162 0.78 NOD1 (0.48) ACACBTNFNOD1
SCHEMBL6490877 0.78 MTTP (0.45) ITGB3ITGA2BACACBTNFNOD1
SCHEMBL6491074 0.78 PPARG (0.41) ITGB3TNFNOD1MTTPAPOB
SCHEMBL6489208 0.77 NOD1 (0.41) ITGB3ITGA2BACACBTNFNOD1

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 1 patent. 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

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 ABCB1 699/4885ABCG2 436/4885ITGB3 2225/4885

“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.