SCHEMBL3879673

SCHEMBL3879673

CC#CCn1c(=O)n(C)c2c(Br)cnc(N3CCN(C(=O)OC(C)(C)C)CC3)c21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.40
KCNH2 Q12809 1/20 0.39
GPR119 Q8TDV5 8/20 0.38
DPP4 P27487 1/20 0.37
MMP13 P45452 2/20 0.37
ADAM17 P78536 2/20 0.37
CKS1B P61024 1/20 0.37
SKP1 P63208 1/20 0.37
SKP2 Q13309 1/20 0.37
MMP1 P03956 1/20 0.37
GBA1 P04062 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
KIT P10721 2/20 0.35
GRIA1 P42261 1/20 0.35

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
SCHEMBL13876151 0.89 KCNH2 (0.44) RETKCNH2GPR119CKS1BSKP1
SCHEMBL3877266 0.82 ACHE (0.40) RETGPR119DPP4MMP13ADAM17
SCHEMBL3882036 0.77 GPR119 (0.40) RETKCNH2GPR119NR1H2NR1H3
SCHEMBL3875573 0.77 DPP4 (0.39) GPR119DPP4NR1H2NR1H3
SCHEMBL3885644 0.75 KIT (0.50) KCNH2GPR119MMP13ADAM17MMP1
SCHEMBL3874252 0.73 CNR1 (0.42) RETGPR119KITGRIA1
SCHEMBL3874827 0.73 GPR119 (0.41) GPR119KIT
SCHEMBL5275990 0.72 DPP4 (0.64) GPR119DPP4
SCHEMBL2952455 0.71 DPP4 (0.43) KCNH2DPP4CKS1BSKP1SKP2
SCHEMBL13867062 0.71 NR1H2 (0.42) RETKCNH2GPR119DPP4CKS1B

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 3 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
EP-1568699-A1 1,3-DIHYDROIMIDAZOLE FUSED-RING COMPOUND Eisai Co., Ltd. (JP) 2005-08-31 EP disclosed