SCHEMBL14721815

SCHEMBL14721815

c1ccc(C2CCN(CCC3CCCc4[nH]ccc43)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.60
SLC18A3 Q16572 1/20 0.51
DRD2 P14416 1/20 0.48
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
ADRA2A P08913 4/20 0.42
ADRA2B P18089 4/20 0.42
ADRA2C P18825 4/20 0.42
HTR7 P34969 2/20 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
SCHEMBL6326828 0.86 SIGMAR1 (0.44) SIGMAR1
SCHEMBL4520692 0.79 SIGMAR1 (0.71) SIGMAR1SLC18A3DRD2CARM1PRMT6
SCHEMBL4098226 0.78 SIGMAR1 (0.60) SIGMAR1SLC18A3DRD2CARM1PRMT6
SCHEMBL957621 0.75 SIGMAR1 (1.00) SIGMAR1SLC18A3DRD2CARM1PRMT6
Oxalic Acid SCHEMBL4533958 0.74 SIGMAR1 (0.65) SIGMAR1SLC18A3DRD2CARM1PRMT6
SCHEMBL14722001 0.74 SIGMAR1 (0.40) SIGMAR1
SCHEMBL954292 0.74 SIGMAR1 (0.77) SIGMAR1SLC18A3DRD2CARM1PRMT6
Oxalic Acid SCHEMBL4108518 0.74 SIGMAR1 (0.55) SIGMAR1SLC18A3DRD2CARM1PRMT6
SCHEMBL955900 0.72 SIGMAR1 (0.77) SIGMAR1SLC18A3DRD2CARM1PRMT6
Oxalic Acid SCHEMBL466885 0.71 SIGMAR1 (0.90) SIGMAR1SLC18A3DRD2CARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013028495-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY (ADP-RIBOSE) POLYMERASE (PARP) FOR THE TREATMENT OF MULTIPLE MYELOMA BIOMARIN PHARMACEUTICAL INC. (US) 2013-02-28 WO claimed
US-20170349554-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. 2017-12-07 US disclosed
US-20140378460-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. (US) 2014-12-25 US disclosed
EP-2747768-A2 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE Cognition Therapeutics, Inc. (US) 2014-07-02 EP disclosed
WO-2013029060-A2 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. (US) 2013-02-28 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 (2 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-20140378460-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE TMEM97, SLC18A2, SIGMAR1 SIGMAR1 3/4885SLC18A3 9/4885DRD2 164/4885
US-20170349554-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE TMEM97, SLC18A2, SIGMAR1 SIGMAR1 3/4885SLC18A3 9/4885DRD2 164/4885

“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.