SCHEMBL3874490

SCHEMBL3874490

CC(C)(C)OC(=O)N1CCN(c2ncnc3c2[nH]c(=O)n3Cc2ccccc2C#N)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.47
DPP4 P27487 6/20 0.44
GPR119 Q8TDV5 4/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
SLC2A1 P11166 1/20 0.40
SLC2A3 P11169 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
ACHE P22303 2/20 0.38
TBK1 Q9UHD2 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
NSD2 O96028 1/20 0.37

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
SCHEMBL3879222 0.83 CNR1 (0.53) KITDPP4GPR119CNR1CNR2
SCHEMBL3883186 0.82 KIT (0.45) KITGPR119CNR1CNR2SLC2A1
SCHEMBL3880941 0.81 CNR1 (0.46) KITDPP4GPR119CNR1CNR2
SCHEMBL3874202 0.76 KIT (0.52) KITGPR119CNR1CNR2SLC2A1
SCHEMBL3875513 0.75 ACHE (0.44) DPP4GPR119NR1H2NR1H3ACHE
SCHEMBL13867062 0.75 NR1H2 (0.42) DPP4GPR119NR1H2NR1H3ACHE
SCHEMBL12517589 0.74 DPP4 (0.70) DPP4GPR119
SCHEMBL13217694 0.74 TNKS (0.41) DPP4GPR119ACHETBK1
SCHEMBL13217686 0.73 TNKS (0.41) DPP4GPR119NR1H2NR1H3ACHE
SCHEMBL12517252 0.72 DPP4 (0.67) DPP4GPR119

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-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed
US-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed
US-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed
US-20060111362-A1 1,3-Dihydroimidazole ring compound EISAI CO., LTD. (JP) 2006-05-25 US disclosed
EP-1568699-A1 1,3-DIHYDROIMIDAZOLE FUSED-RING COMPOUND Eisai Co., Ltd. (JP) 2005-08-31 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-20060111362-A1 1,3-Dihydroimidazole ring compound NR2C2, NR0B2, DPP4 KIT 4046/4885DPP4 3/4885GPR119 172/4885

“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.