SCHEMBL1490003

SCHEMBL1490003

COCCN(C)C1CC[N]CC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.35
HRH1 P35367 1/20 0.35
KCNH2 Q12809 1/20 0.35
PIK3CD O00329 1/20 0.32
PDE7A Q13946 1/20 0.32
TACR1 P25103 1/20 0.30
CD38 P28907 1/20 0.30
SMYD3 Q9H7B4 1/20 0.30

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
SCHEMBL1490136 0.89 CYP2D6 (0.32) CYP2D6HRH1KCNH2PIK3CD
SCHEMBL1489627 0.89 CYP2D6 (0.32) CYP2D6HRH1KCNH2PIK3CD
SCHEMBL3436793 0.85
Hydrochloric Acid SCHEMBL4349290 0.83 PIK3CD (0.37) CYP2D6HRH1KCNH2PIK3CDPDE7A
SCHEMBL3436790 0.83 PIK3CD (0.37) CYP2D6HRH1KCNH2PIK3CDPDE7A
SCHEMBL5857573 0.82 SLC6A2 (0.35) KCNH2PIK3CD
SCHEMBL18878200 0.81 ACHE (0.37) CYP2D6HRH1KCNH2PIK3CDPDE7A
SCHEMBL20160908 0.79 PIK3CD (0.34) CYP2D6HRH1KCNH2PIK3CDPDE7A
SCHEMBL8272566 0.79 HRH4 (0.40) PDE7A
SCHEMBL16133619 0.78 CYP2D6 (0.33) CYP2D6HRH1KCNH2PIK3CDPDE7A

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
EP-1888565-B1 2, 6-DI (HETERO) ARYL -4-AMIDO-PYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS ALMIRALL SA (ES) 2011-03-23 EP disclosed
US-7112594-B2 Fused bicyclic amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-09-26 US disclosed
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
US-20030203909-A1 Fused bicyclic amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-10-30 US disclosed
EP-1310488-A1 FUSED BICYCLIC AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-05-14 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 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-20030203909-A1 Fused bicyclic amide compounds and medicinal use thereof BET1, NFATC1, ARG1 CYP2D6 1468/4885HRH1 30/4885KCNH2 130/4885

“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.