SCHEMBL3811241

SCHEMBL3811241

CN(Cc1ccc(C(=O)N2CC3(C)CC2CC(C)(C)C3)cc1)C(=O)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 11/20 0.58
AVPR2 P30518 7/20 0.58
ALDH1A1 P00352 4/20 0.57
MEN1 O00255 1/20 0.57
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57
LMNA P02545 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
HPGD P15428 1/20 0.55
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL14532089 1.00 AVPR1A (0.58) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3813359 0.91 LMNA (0.57) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL4607419 0.91 ALDH1A1 (0.63) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3813805 0.89 LMNA (0.57) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL14531718 0.89 LMNA (0.56) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3818171 0.88 ALDH1A1 (0.55) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3819863 0.88 ALDH1A1 (0.53) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3813718 0.88 ALDH1A1 (0.62) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3813675 0.88 LMNA (0.55) AVPR1AAVPR2ALDH1A1MEN1HTT
SCHEMBL3809682 0.88 AVPR1A (0.53) AVPR1AAVPR2ALDH1A1MEN1HTT

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
US-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-14 US claimed
US-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-14 US disclosed
US-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-14 US disclosed
US-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HIGH POINT PHARMACEUTICALS, LLC 2009-05-14 US disclosed
EP-1948190-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2008-07-30 EP disclosed
WO-2007051810-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 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-20090124598-A1 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES HSD11B1, HSD11B2, HSD3B1 AVPR1A 878/4885AVPR2 861/4885ALDH1A1 220/4885

“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.