SCHEMBL4393264

SCHEMBL4393264

CN1CCN(CNCN2CCN(C)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.39
MC4R P32245 1/20 0.38
PAOX Q6QHF9 1/20 0.35
LMNA P02545 1/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
CSNK2A3 Q8NEV1 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.34
ACE2 Q9BYF1 1/20 0.33
KDM1A O60341 1/20 0.33
CHKA P35790 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
SCHEMBL8398744 0.83 KDM4E (0.37) NPSR1MC4RSIGMAR1ACE2KDM1A
SCHEMBL15827533 0.81 MC4R (0.31) NPSR1MC4RCSNK2A2CSNK2BCSNK2A1
SCHEMBL8070403 0.81 HRH4 (0.35) NPSR1MC4RCSNK2A2CSNK2BCSNK2A1
SCHEMBL792900 0.80 CARM1 (0.39) NPSR1MC4RPAOXLMNACSNK2A2
SCHEMBL22066263 0.78 LMNA (0.38) NPSR1MC4RPAOXLMNACSNK2A2
SCHEMBL4394196 0.78 DRD2 (0.42) NPSR1SIGMAR1ACE2
SCHEMBL21664499 0.78 KDM4E (0.41) CSNK2A2CSNK2BCSNK2A1CSNK2A3HTT
SCHEMBL7562171 0.78 NPSR1 (0.37) NPSR1MC4RPAOXCSNK2A2CSNK2B
SCHEMBL4402668 0.77 NPSR1 (0.39) NPSR1LMNASIGMAR1
SCHEMBL4392341 0.76 ACE2 (0.50) PAOXCSNK2A2CSNK2BCSNK2A1CSNK2A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME MITSUI CHEMICALS, INC. (JP) 2009-12-10 US disclosed
US-20070054084-A1 Optical recording medium and compound used for the same MITSUI CHEMICALS, INC. (JP) 2007-03-08 US disclosed
EP-1672626-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED IN THE OPTICAL RECORDING MEDIUM Mitsui Chemicals, Inc. (JP) 2006-06-21 EP 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-20090306376-A1 OPTICAL RECORDING MEDIUM AND COMPOUND USED FOR THE SAME CACNA1B, KCNN4, KCNN2 NPSR1 468/4885MC4R 1490/4885PAOX 3615/4885

“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.