SCHEMBL10184293

SCHEMBL10184293

COC(=O)C[C@H]1CC[C@@H](Oc2ccc(C(=O)NCCN)c(F)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.48
SCN9A Q15858 2/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
PARP10 Q53GL7 2/20 0.38
PARP15 Q460N3 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CNR2 P34972 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
CRBN Q96SW2 1/20 0.35
ACACB O00763 1/20 0.35
MAPK1 P28482 1/20 0.35
IKBKB O14920 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL10186395 0.85 NR1H4 (0.44) HRH3
SCHEMBL10148299 0.85 HRH3 (0.45) HRH3SCN9APARP10PARP15FFAR4
SCHEMBL10148296 0.85 HRH3 (0.45) HRH3SCN9APARP10PARP15FFAR4
SCHEMBL10185065 0.84 SCN9A (0.41) SCN9A
SCHEMBL10186118 0.84 LMNA (0.48) HRH3MEN1KMT2A
SCHEMBL10184829 0.81 HRH3 (0.48) HRH3PTGS1PTGS2CRBNMEN1
SCHEMBL10185067 0.79 AR (0.45) HRH3MEN1KMT2A
SCHEMBL10186399 0.78 CRBN (0.41) HRH3ITGB3ITGA2BFFAR4PTGS1
SCHEMBL10185777 0.75 DGAT1 (0.45) HRH3FFAR4ACSL1
SCHEMBL10184530 0.75 DGAT1 (0.44) HRH3FFAR4ACSL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
WO-2010122968-A1 DIACYLETHYLENEDIAMINE COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND DGAT1, DGAT2, DIMT1 HRH3 2422/4885SCN9A 3832/4885ITGB3 4775/4885

“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.