SCHEMBL2580702

SCHEMBL2580702

CCC1CC(=O)NN=C1c1ccc(N)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.56
PDE2A O00408 1/20 0.51
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
GALR3 O60755 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL9781549 0.88 GPR119 (0.55) GPR119PDE2APDE3BPDE3AGALR3
SCHEMBL9686555 0.84 GPR119 (0.60) GPR119PDE2APDE3BPDE3A
SCHEMBL2583128 0.83 GALR3 (0.66) PDE3BPDE3AGALR3MAPTTHRB
SCHEMBL6934765 0.83 GPR119 (0.61) GPR119PDE2APDE3BPDE3A
SCHEMBL9686622 0.82 GPR119 (0.56) GPR119PDE2APDE3BPDE3A
SCHEMBL9686762 0.81 GPR119 (0.66) GPR119PDE2APDE3BPDE3A
SCHEMBL7352543 0.81 MAPT (0.73) GPR119PDE2APDE3BPDE3AGALR3
SCHEMBL7340003 0.77 GPR119 (0.53) GPR119PDE2APDE3BPDE3A
SCHEMBL9686758 0.77 PDE2A (0.62) GPR119PDE2APDE3BPDE3A
SCHEMBL9686551 0.77 GPR119 (0.56) GPR119PDE2APDE3BPDE3A

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
EP-2566864-B1 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INT (DE) 2014-09-03 EP disclosed
US-8772323-B2 Benzoxazole- and tetrahydrobenzoxazole-substituted pyridazinones as GPR119 agonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-08 US disclosed
US-20130172323-A1 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-07-04 US disclosed
EP-2566864-A2 PYRIDAZINONES AS GPR119 AGONISTS Boehringer Ingelheim International GmbH (DE) 2013-03-13 EP disclosed
WO-2011138427-A2 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 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-20130172323-A1 PYRIDAZINONES AS GPR119 AGONISTS GPR65, GPR119, GPR55 GPR119 2/4885PDE2A 1099/4885PDE3B 915/4885

“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.