SCHEMBL7196400

SCHEMBL7196400

CCOc1ccc(Cn2c(C)nc3c(C)cc(COc4c(C)cccc4C(=O)O)cc32)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 5/20 0.40
FABP3 P05413 1/20 0.37
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37
DCTPP1 Q9H773 1/20 0.37
S1PR1 P21453 1/20 0.36
PRKX P51817 1/20 0.36
ACVR1 Q04771 1/20 0.36
S1PR5 Q9H228 1/20 0.36
AGTR1 P30556 4/20 0.36
PIK3CB P42338 2/20 0.36
AGTR2 P50052 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
PPARG P37231 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
SCHEMBL7200058 0.90 FABP3 (0.48) PIK3C2BFABP3FABP4FABP5PIK3CB
SCHEMBL7200216 0.90 PIK3C2B (0.41) PIK3C2BFABP3FABP4FABP5DCTPP1
SCHEMBL6498814 0.89 S1PR1 (0.39) PIK3C2BDCTPP1S1PR1PRKXACVR1
SCHEMBL6489346 0.87 MRGPRX4 (0.46) MRGPRX4PPARG
SCHEMBL7193408 0.85 PIK3C2B (0.42) PIK3C2BDCTPP1PIK3CBMRGPRX4PPARG
SCHEMBL6487408 0.83 DCTPP1 (0.38) DCTPP1S1PR1PRKXACVR1S1PR5
SCHEMBL6499333 0.83 BCL2 (0.50) PIK3C2B
SCHEMBL7659283 0.83 PIK3C2B (0.47) PIK3C2BDCTPP1PIK3CBPPARG
SCHEMBL6490528 0.82 DCTPP1 (0.42) DCTPP1MRGPRX4PPARG
SCHEMBL6489201 0.81 DCTPP1 (0.40) DCTPP1

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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed