SCHEMBL14722649

SCHEMBL14722649

c1ccc(CC(c2ccccc2)N2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2D6 P10635 1/20 0.68
TSHR P16473 1/20 0.68
CYP2C19 P33261 1/20 0.68
HRH3 Q9Y5N1 1/20 0.68
SLC6A4 P31645 3/20 0.64
SLC6A2 P23975 2/20 0.64
SIGMAR1 Q99720 2/20 0.60
ATM Q13315 1/20 0.59
OPRM1 P35372 1/20 0.56
OPRD1 P41143 1/20 0.56
OPRK1 P41145 1/20 0.56
OPRL1 P41146 1/20 0.56
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MC4R P32245 1/20 0.51
SCN5A Q14524 1/20 0.51
SCN9A Q15858 1/20 0.51

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
SCHEMBL14731798 1.00 CYP1A2 (0.68) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL11504581 0.83 CYP1A2 (0.62) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL9366741 0.82 CYP1A2 (0.96) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
Hydrochloric Acid SCHEMBL11504984 0.82 SLC6A2 (0.71) TSHRSLC6A4SLC6A2SIGMAR1KDM4E
SCHEMBL7398421 0.81 SIGMAR1 (0.65) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL11504852 0.81 CYP1A2 (0.60) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL9366351 0.81 CYP2D6 (0.70) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL7311276 0.81 ATM (0.84) CYP1A2CYP3A4CYP2D6CYP2C19SLC6A4
SCHEMBL3715253 0.81 CYP1A2 (1.00) CYP1A2CYP3A4CYP2D6TSHRCYP2C19
SCHEMBL8984720 0.81 CYP1A2 (0.64) CYP1A2CYP3A4CYP2D6TSHRCYP2C19

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
US-20140378460-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. (US) 2014-12-25 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 CYP1A2 3215/4885CYP3A4 4754/4885CYP2D6 4309/4885
US-20170349554-A1 COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE TMEM97, SLC18A2, SIGMAR1 CYP1A2 3215/4885CYP3A4 4754/4885CYP2D6 4309/4885

“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.