SCHEMBL14720645

SCHEMBL14720645

c1ccc(C2CCC(N3CCN(C4CCCCC4)CC3)CC2)cc1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.83
CYP2D6 P10635 1/20 0.77
CYP2C19 P33261 1/20 0.77
SMN1; SMN2 Q16637 2/20 0.65
HPGD P15428 1/20 0.65
KMT2A Q03164 1/20 0.65
ABCB1 P08183 2/20 0.58
GRIN2B Q13224 2/20 0.57
TRPV6 Q9H1D0 6/20 0.56
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 1/20 0.55
HRH3 Q9Y5N1 1/20 0.52

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
SCHEMBL24163290 0.98 SLC18A3 (0.79) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL11121512 0.91 SLC18A3 (1.00) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL28702035 0.91 CYP2D6 (0.93) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL7888827 0.91 SLC18A3 (1.00) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL7879553 0.89 SLC18A3 (0.96) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL30563652 0.89 SLC18A3 (0.96) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL15184744 0.89 CYP2D6 (0.83) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL13498019 0.87 CYP2D6 (1.00) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL2965273 0.84 SLC18A3 (0.81) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD
SCHEMBL23921799 0.84 CYP2D6 (0.65) SLC18A3CYP2D6CYP2C19SMN1; SMN2HPGD

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
US-20170349554-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. 2017-12-07 US disclosed
CN-107260726-A Composition and method for treating nerve degenerative diseases 考格尼申治疗股份有限公司 2017-10-20 CN 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 SLC18A3 9/4885CYP2D6 4309/4885CYP2C19 4656/4885
US-20170349554-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE TMEM97, SLC18A2, SIGMAR1 SLC18A3 9/4885CYP2D6 4309/4885CYP2C19 4656/4885

“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.