SCHEMBL7480263

SCHEMBL7480263

CN(c1ccc2nc[nH]c2c1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.44
MAP4K4 O95819 1/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HSD11B1 P28845 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 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
SCHEMBL7480254 0.92 GPR119 (0.44) GPR119MAP4K4MEN1KMT2A
SCHEMBL23360552 0.80 GPR119 (0.49) GPR119MAP4K4MEN1KMT2A
SCHEMBL7483469 0.78 ALDH1A1 (0.58) GPR119MEN1KMT2AALDH1A1
SCHEMBL23360515 0.78 GPR119 (0.48) GPR119MEN1KMT2A
SCHEMBL29862993 0.78 GPR119 (0.48) GPR119MEN1KMT2A
SCHEMBL22608999 0.77 PDE4B (0.57) MEN1KMT2AHSD11B1ALDH1A1HPGD
SCHEMBL2128743 0.77 NPC1 (0.64) MEN1KMT2AALDH1A1HPGD
SCHEMBL27391167 0.77 MEN1 (0.53) GPR119MEN1KMT2A
SCHEMBL20765762 0.76 L3MBTL1 (0.62) MEN1KMT2AHSD11B1ALDH1A1HPGD
SCHEMBL30826597 0.76 MEN1 (0.46) GPR119MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865281-B1 NAPHTHYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS ANTICOAGULANTS BERLEX LAB (US) 2002-04-03 EP disclosed
US-5849759-A Naphthyl-substituted benzimidazole derivatives as anti-coagulants BERLEX LABORATORIES, INC. (US) 1998-12-15 US disclosed