SCHEMBL2402365

SCHEMBL2402365

CC(C)CN1CCCC1NC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
CHRM3 P20309 1/20 0.45
PREP P48147 1/20 0.44
FAP Q12884 1/20 0.44
ACE P12821 2/20 0.43
CYP3A4 P08684 1/20 0.43
CHRM1 P11229 1/20 0.43
HPGD P15428 1/20 0.43
OPRM1 P35372 1/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41

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
SCHEMBL2399783 0.85 NPSR1 (0.49) NPSR1CARM1PRMT6CHRM1HPGD
SCHEMBL2400798 0.80 ALDH1A1 (0.47) NPSR1CARM1PRMT6CHRM3PREP
SCHEMBL2401169 0.79 CARM1 (0.52) NPSR1CARM1PRMT6HPGDCTSL
SCHEMBL3099776 0.75 MEN1 (0.44) NPSR1CARM1PRMT6PREPFAP
SCHEMBL3105144 0.75 HRH3 (0.47) NPSR1CARM1PRMT6CHRM1HPGD
SCHEMBL2401685 0.74 MEN1 (0.48) NPSR1CARM1PRMT6PREPFAP
SCHEMBL2399591 0.73 POLB (0.45) NPSR1CARM1PRMT6LMNAALDH1A1
SCHEMBL10694282 0.72 NPSR1 (0.42) NPSR1CARM1PRMT6PREPFAP
SCHEMBL18838432 0.71 CYP2D6 (0.43) NPSR1CARM1PRMT6CYP3A4HPGD
SCHEMBL27604695 0.71 DPP7 (0.48) NPSR1CYP3A4CTSLCTSBCTSK

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-20130225644-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2013-08-29 US disclosed
US-8431540-B2 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2013-04-30 US disclosed
US-20120245106-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS ZEALAND PHARMA A/S (DK) 2012-09-27 US disclosed
US-8026272-B2 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2011-09-27 US disclosed
US-20100249206-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS Zealand Pharma A/S and Wyeth 2010-09-30 US disclosed
US-7622496-B2 antiarrhythmia agents; 1-(2-Amino-acetyl)-4-(benzoylamino)-pyrrolidine-2-carboxylic acid; desirable bioavailability properties ZEALAND PHARMA A/S (DK) 2009-11-24 US disclosed
US-20070149460-A1 Modified lysine-mimetic compounds ZEALAND PHARMA A/S (DK) 2007-06-28 US 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 (4 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-20120245106-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 NPSR1 2974/4885CARM1 402/4885PRMT6 144/4885
US-20130225644-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 NPSR1 2974/4885CARM1 402/4885PRMT6 144/4885
US-20100249206-A1 MODIFIED LYSINE-MIMETIC COMPOUNDS MYLK2, KCNN2, KCNN1 NPSR1 2974/4885CARM1 402/4885PRMT6 144/4885
US-20070149460-A1 Modified lysine-mimetic compounds MYLK2, KCNN2, KCNN1 NPSR1 2974/4885CARM1 402/4885PRMT6 144/4885

“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.