SCHEMBL3601115

SCHEMBL3601115

N#Cc1cccc(O[C@H]2CN3CCC2CC3)c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.50
SLC6A3 Q01959 2/20 0.50
SLC6A4 P31645 1/20 0.50
MGLL Q99685 2/20 0.44
LSS P48449 1/20 0.44
HRH1 P35367 1/20 0.42
CCR3 P51677 1/20 0.42

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
SCHEMBL9469406 1.00 SLC6A2 (0.50) SLC6A2SLC6A3SLC6A4MGLLLSS
SCHEMBL9469447 0.82 LSS (0.55) LSS
SCHEMBL3844537 0.80 USP30 (0.45) SLC6A2SLC6A3
SCHEMBL3238913 0.79 LSS (0.49) LSS
SCHEMBL1848679 0.79 CHRM2 (0.47) SLC6A2SLC6A3SLC6A4LSS
SCHEMBL13495085 0.79 ALDH1A1 (0.55) SLC6A2SLC6A3SLC6A4LSS
SCHEMBL9469879 0.79 CHRNB2 (0.48) SLC6A2SLC6A3SLC6A4LSS
SCHEMBL3238906 0.79 LSS (0.49) LSS
SCHEMBL3215247 0.79 TSHR (0.56) SLC6A2SLC6A3SLC6A4LSS
SCHEMBL1849637 0.79 CHRM2 (0.47) SLC6A2SLC6A3SLC6A4LSS

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-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 US disclosed
US-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 US disclosed
WO-2008099186-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS ARGENTA DISCOVERY LIMITED (GB) 2008-08-21 WO disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP SLC6A2 1701/4885SLC6A3 839/4885SLC6A4 1751/4885
US-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors CHRM2, CHRM3, CHRM1 SLC6A2 2540/4885SLC6A3 1295/4885SLC6A4 2319/4885

“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.