SCHEMBL6487457

SCHEMBL6487457

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

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.47
ABCB1 P08183 10/20 0.39
ABCG2 Q9UNQ0 9/20 0.39
ACACB O00763 1/20 0.37
APOB P04114 3/20 0.37
MTTP P55157 3/20 0.37
TNF P01375 1/20 0.37
NOD1 Q9Y239 1/20 0.37
NR1I3 Q14994 1/20 0.36
SMO Q99835 1/20 0.36

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
SCHEMBL6496773 0.90 ABCB1 (0.40) ABCB1ABCG2ACACBAPOBMTTP
SCHEMBL6498905 0.87 ABCB1 (0.42) ABCB1ABCG2APOBMTTPSMO
SCHEMBL6490132 0.87 LCK (0.39) DRD2
SCHEMBL6489158 0.84 SMO (0.46) ABCB1ABCG2APOBMTTPSMO
SCHEMBL6490538 0.82 CHRNB2 (0.38) APOBMTTPSMO
SCHEMBL6489620 0.81 ABCB1 (0.51) DRD2ABCB1ABCG2TNFNOD1
SCHEMBL6491779 0.80 ACACB (0.43) ACACBAPOBMTTP
SCHEMBL6490168 0.80 RXFP1 (0.35) APOBMTTPSMO
SCHEMBL6489848 0.78 CCNC (0.44)
SCHEMBL6488027 0.78 ESR2 (0.50) ABCB1APOBMTTP

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 DRD2 2927/4885ABCB1 699/4885ABCG2 436/4885

“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.