SCHEMBL6408912

SCHEMBL6408912

Cn1ncc2nc(N3CCN(C(=O)O)C(C(C)(C)C)C3)[nH]c2c1=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 5/20 0.34
HTR3A P46098 1/20 0.34
MGLL Q99685 7/20 0.32
DCTPP1 Q9H773 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL27623279 0.81 HTR3A (0.40) HTR3AMGLLDCTPP1TP53MAPT
SCHEMBL2960897 0.73 KAT2B (0.38)
SCHEMBL13217366 0.71 HTR3A (0.44) HTR3ADCTPP1
SCHEMBL6417245 0.71 DPP4 (0.34)
SCHEMBL27623316 0.68 HTR2B (0.41)
SCHEMBL29252729 0.66 AGTR2 (0.48)
SCHEMBL6889140 0.65 ALDH1A1 (0.43) HTR3AMGLLMAPT
SCHEMBL22519008 0.65 CHRM1 (0.46) SLC6A9
SCHEMBL4749555 0.65 KDM4E (0.42) SLC6A9
SCHEMBL4532377 0.65 HTR3A (0.53) HTR3A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1514552-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE Eisai Co., Ltd. (JP) 2005-03-16 EP disclosed