SCHEMBL6500969

SCHEMBL6500969

Nc1cccc(CC(=O)N2CCN(c3ccc(NC(=O)C4=C(c5ccc(C(F)(F)F)cc5)CCCC4)cc3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.45
CDK8 P49336 1/20 0.45
ME2 P23368 1/20 0.44
ME1 P48163 1/20 0.44
ME3 Q16798 1/20 0.44
LCK P06239 2/20 0.41
HCK P08631 2/20 0.41
KDR P35968 2/20 0.41
SRC P12931 1/20 0.41
MAPT P10636 3/20 0.41
BTK Q06187 4/20 0.40
MAPKAPK2 P49137 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
NAMPT P43490 1/20 0.39
KCNH2 Q12809 1/20 0.39
DGAT1 O75907 2/20 0.38
USP2 O75604 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL6491110 0.89 SMN1; SMN2 (0.46) MAPTTRPV1DGAT1CA12CA2
SCHEMBL6501876 0.88 CA1 (0.42) LCKHCKKDRSRCBTK
SCHEMBL6500009 0.87 PHGDH (0.49) CCNCCDK8ME2ME1ME3
SCHEMBL6490499 0.87 ME2 (0.43) CCNCCDK8ME2ME1ME3
SCHEMBL6489848 0.86 CCNC (0.44) CCNCCDK8ME2ME1ME3
SCHEMBL6488407 0.85 LMNA (0.47) KDR
SCHEMBL6488806 0.82 RIPK1 (0.46) LCKMAPTCYP3A4CYP2C9
SCHEMBL6491821 0.82 CXCR4 (0.41) KDRMAPTTRPV1
SCHEMBL6502046 0.81 ME2 (0.41) CCNCCDK8ME2ME1ME3
SCHEMBL6491864 0.80 MAPT (0.46) MAPTDGAT1

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 CCNC 2124/4885CDK8 3488/4885ME2 1669/4885

“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.