SCHEMBL6497091

SCHEMBL6497091

N#Cc1ccc(CN2CCc3cc(NC(=O)C4=C(c5ccc(C(F)(F)F)cc5)CCCC4)ccc3C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 1/20 0.52
ACACB O00763 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
NOD1 Q9Y239 6/20 0.45
TNF P01375 4/20 0.44
NOD2 Q9HC29 4/20 0.44
PLAU P00749 1/20 0.43
HIF1A Q16665 3/20 0.42
EPAS1 Q99814 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
AR P10275 1/20 0.41
CLPP Q16740 1/20 0.41

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
SCHEMBL6498841 0.92 CLPP (0.52) PRKAA2ACACBMEN1KMT2ARAB9A
SCHEMBL6499211 0.86 MEN1 (0.42) PRKAA2ACACBMEN1KMT2ARAB9A
SCHEMBL6491162 0.86 NOD1 (0.48) ACACBMEN1KMT2ARAB9ANOD1
SCHEMBL6501845 0.85 NOD1 (0.47) ACACBMEN1KMT2ARAB9ANPC1
SCHEMBL6498359 0.83 TNF (0.49) ACACBNOD1TNFNOD2
SCHEMBL6489208 0.82 NOD1 (0.41) ACACBMEN1KMT2ARAB9ANOD1
SCHEMBL6489620 0.82 ABCB1 (0.51) NOD1TNFHIF1AEPAS1
SCHEMBL6502283 0.81 NOD1 (0.40) PRKAA2ACACBMEN1KMT2ARAB9A
SCHEMBL6498924 0.81 SRPK1 (0.44) ACACBNOD1TNFNOD2HIF1A
SCHEMBL6490877 0.81 MTTP (0.45) ACACBNOD1TNFNOD2HIF1A

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 PRKAA2 2359/4885ACACB 108/4885MEN1 1991/4885

“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.