SCHEMBL7385010

SCHEMBL7385010

CCOC(=O)C(Cc1occ2cc(C#N)ccc12)c1ccc(O[C@H]2C[C@@H](C(=O)N(C)C)N(C(=O)OC(C)(C)C)C2)cc1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.37
MCL1 Q07820 18/20 0.36
BCL2 P10415 1/20 0.34
BCL2L1 Q07817 1/20 0.34

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
SCHEMBL7379072 0.93 GPR119 (0.37) GPR119MCL1BCL2BCL2L1
SCHEMBL7385008 0.87 F10 (0.47) GPR119MCL1
SCHEMBL7384317 0.85 GPR119 (0.49) GPR119
SCHEMBL7387009 0.81 F10 (0.38) GPR119
SCHEMBL7387970 0.80 GPR119 (0.41) GPR119
SCHEMBL7391175 0.80 HRH3 (0.41)
SCHEMBL7379068 0.79 F10 (0.51) GPR119MCL1
SCHEMBL7388570 0.78 F10 (0.41) GPR119
SCHEMBL7380630 0.77 GPR119 (0.39) GPR119MCL1
SCHEMBL7390197 0.74 TP53 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5620991-A ANTICOAGULANTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-15 US disclosed
US-5576343-A ANTICOAGULANTS; BLOOD-COAGULATION FACTOR X INHIBITORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-11-19 US disclosed
EP-0540051-B1 Aromatic amidine derivatives and salts thereof DAIICHI SEIYAKU CO (JP) 1996-04-03 EP disclosed
EP-0540051-A1 Aromatic amidine derivatives and salts thereof DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-05-05 EP disclosed