SCHEMBL7484170

SCHEMBL7484170

Cc1nc2cc(OC3CCN(C(=O)OC(C)(C)C)CC3)c(OC3CCN(C(=O)OCc4ccccc4)CC3)cc2n1Cc1ccc(C#N)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.40
TBK1 Q9UHD2 6/20 0.40
PDE4B Q07343 2/20 0.40
BRD4 O60885 3/20 0.39
CETP P11597 1/20 0.37
PRMT5 O14744 1/20 0.37
GPR119 Q8TDV5 4/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
PGGT1B P53609 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
IKBKE Q14164 1/20 0.36

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
SCHEMBL7477494 0.90 TBK1 (0.42) NSD2TBK1PDE4BBRD4CETP
SCHEMBL7483915 0.90 NSD2 (0.42) NSD2TBK1PDE4BBRD4GPR119
SCHEMBL7483999 0.89 NSD2 (0.41) NSD2TBK1PDE4BBRD4GPR119
SCHEMBL7478116 0.89 NSD2 (0.41) NSD2TBK1PDE4BBRD4GPR119
SCHEMBL7481361 0.89 TBK1 (0.41) NSD2TBK1PDE4BBRD4CETP
SCHEMBL7484173 0.89 TBK1 (0.41) NSD2TBK1PDE4BBRD4CETP
SCHEMBL7477562 0.88 NSD2 (0.40) NSD2TBK1PDE4BGPR119IKBKE
SCHEMBL7488680 0.88 TBK1 (0.40) NSD2TBK1PDE4BCETPGPR119
SCHEMBL7483596 0.88 TBK1 (0.40) NSD2TBK1PDE4BPRMT5GPR119
SCHEMBL7475851 0.88 TBK1 (0.40) NSD2TBK1PDE4BBRD4GPR119

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