SCHEMBL3602267

SCHEMBL3602267

N#Cc1cccc(N2CC[C@@H](O)C2)c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.67
AR P10275 1/20 0.58
DRD2 P14416 4/20 0.56
DRD3 P35462 3/20 0.56
LRRK2 Q5S007 4/20 0.45
PDE4D Q08499 1/20 0.45
MAP4K1 Q92918 1/20 0.43
NPY5R Q15761 1/20 0.43
LCAT P04180 1/20 0.43
CHRM4 P08173 1/20 0.42
ALOX5 P09917 1/20 0.42
C1S P09871 1/20 0.41
P2RX7 Q99572 1/20 0.41

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
SCHEMBL7491396 1.00 NOTUM (0.67) NOTUMARDRD2DRD3LRRK2
SCHEMBL2732722 0.91 DRD2 (0.64) NOTUMARDRD2DRD3LRRK2
SCHEMBL21624920 0.82 NOTUM (0.63) NOTUMARDRD2DRD3LRRK2
SCHEMBL21624919 0.82 NOTUM (0.63) NOTUMARDRD2DRD3LRRK2
SCHEMBL320725 0.81 AR (0.60) NOTUMAR
SCHEMBL10277569 0.81 AR (0.60) NOTUMAR
SCHEMBL20076216 0.81 AR (0.60) NOTUMAR
SCHEMBL25080875 0.78 NOTUM (0.59) NOTUMDRD2DRD3CHRM4
SCHEMBL25080895 0.78 BPTF (0.64) NOTUMDRD2DRD3CHRM4C1S
SCHEMBL29012566 0.78 BPTF (0.64) NOTUMDRD2DRD3CHRM4C1S

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 NOTUM 2133/4885AR 4417/4885DRD2 1842/4885

“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.