SCHEMBL3455352

SCHEMBL3455352

CC1(C)CC2CC(C)(CN2C(=O)c2ccc3c(C(=O)C(Cl)(Cl)Cl)c[nH]c3c2)C1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 14/20 0.56
AVPR2 P30518 11/20 0.56
LMNA P02545 1/20 0.53
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 1/20 0.52
HSD11B1 P28845 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL3457701 0.90 AVPR1A (0.59) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3454887 0.88 AVPR1A (0.57) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3456461 0.84 AVPR1A (0.56) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3454911 0.83 AVPR1A (0.62) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3454755 0.82 AVPR1A (0.61) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3455664 0.82 AVPR1A (0.56) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3459774 0.81 LMNA (0.54) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3454789 0.81 LMNA (0.58) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3454873 0.80 AVPR1A (0.55) AVPR1AAVPR2LMNAALDH1A1MEN1
SCHEMBL3459953 0.80 AVPR1A (0.59) AVPR1AAVPR2LMNAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2239012-A2 Pharmaceutical use of substituted amides High Point Pharmaceuticals, LLC (US) 2010-10-13 EP disclosed
US-20090264414-A1 Amide Derivatives and Pharmaceutical Use Thereof HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
US-20080108598-A1 Pharmaceutical use of substituted amides NOVO NORDISK A/S (DK) 2008-05-08 US disclosed
US-20060111366-A1 Pharmaceutical use of substituted amides NOVO NORDISK A/S (DK) 2006-05-25 US disclosed
EP-1615698-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2006-01-18 EP disclosed
WO-2004089470-A2 NEW AMIDE DERIVATIVES AND PHARMACEUTICAL USE THEREOF NOVO NORDISK A/S (DK) 2004-10-21 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 (3 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-20080108598-A1 Pharmaceutical use of substituted amides HSD11B1, HSD3B1, HSD11B2 AVPR1A 935/4885AVPR2 902/4885LMNA 3468/4885
US-20090264414-A1 Amide Derivatives and Pharmaceutical Use Thereof HSD11B1, HSD11B2, HSD3B1 AVPR1A 952/4885AVPR2 835/4885LMNA 3531/4885
US-20060111366-A1 Pharmaceutical use of substituted amides HSD11B1, HSD3B1, HSD11B2 AVPR1A 935/4885AVPR2 902/4885LMNA 3468/4885

“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.