SCHEMBL3608160

SCHEMBL3608160

CN1CCCC(Oc2cccc(C#N)c2)C1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.59
DRD2 P14416 4/20 0.59
SLC6A2 P23975 2/20 0.53
SLC6A3 Q01959 2/20 0.53
SLC6A4 P31645 1/20 0.53
HRH3 Q9Y5N1 1/20 0.51
ALDH1A1 P00352 1/20 0.48
HRH1 P35367 2/20 0.47
CCR3 P51677 2/20 0.47
CYP2D6 P10635 1/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45
CASP1 P29466 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
CHRM4 P08173 1/20 0.44

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
SCHEMBL4440335 0.93 DRD3 (0.52) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL3289104 0.86 HRH3 (0.68) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL16382665 0.86 SLC6A2 (0.57) DRD3DRD2SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL4227255 0.85 HRH3 (0.67) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL11457969 0.85 DRD3 (0.56) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL4236282 0.84 DRD2 (0.61) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL6496199 0.81 SLC6A2 (0.66) SLC6A2SLC6A3SLC6A4HRH3HRH1
SCHEMBL26049997 0.81 SLC6A2 (0.66) DRD3DRD2SLC6A2SLC6A3SLC6A4
SCHEMBL24394537 0.81 ALDH1A1 (0.62) DRD2SLC6A2SLC6A3SLC6A4HRH3
SCHEMBL13452625 0.81 ALDH1A1 (0.49) ALDH1A1CYP2D6CHRM4

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 4 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
EP-2121703-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS AstraZeneca AB (SE) 2009-11-25 EP disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 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 (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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP DRD3 2558/4885DRD2 1842/4885SLC6A2 1701/4885

“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.