SCHEMBL3811254

SCHEMBL3811254

CN(Cc1ccc(C(=O)N2CC3CCC(C)(C2)C3(C)C)cc1)S(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CA2 P00918 1/20 0.36
HPGD P15428 3/20 0.35
LMNA P02545 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KCNH2 Q12809 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.34
LSS P48449 1/20 0.34
GAA P10253 1/20 0.34
CNR2 P34972 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.34
F10 P00742 2/20 0.34
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33

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
SCHEMBL4608840 0.90 ALDH1A1 (0.38) ALDH1A1HRH3CA2HPGDLMNA
SCHEMBL12576932 0.88 HRH3 (0.37) ALDH1A1HRH3CA2HPGDLMNA
SCHEMBL3812022 0.82 HDAC1 (0.46) ALDH1A1HPGDLMNAKMT2AGAA
SCHEMBL3814369 0.81 HRH3 (0.39) ALDH1A1HRH3HPGDKCNH2SMN1; SMN2
SCHEMBL12640409 0.81 CA2 (0.38) ALDH1A1HRH3CA2HPGDLMNA
SCHEMBL3811439 0.79 LMNA (0.37) ALDH1A1HRH3HPGDLMNAKCNH2
SCHEMBL3811818 0.79 AOC3 (0.40) ALDH1A1HRH3HPGDLMNASMN1; SMN2
SCHEMBL4608059 0.79 NAMPT (0.36) ALDH1A1CA2HPGDGAA
SCHEMBL3811384 0.79 CCR5 (0.40) ALDH1A1HRH3SMN1; SMN2KMT2ALSS
SCHEMBL3819063 0.77 LMNA (0.54) ALDH1A1HRH3HPGDLMNANPSR1

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 7 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
EP-1948190-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2008-07-30 EP claimed
WO-2007051810-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 WO 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
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 ALDH1A1 220/4885HRH3 468/4885CA2 2011/4885

“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.