SCHEMBL7380630

SCHEMBL7380630

CCOC(=O)C(Cc1cc2cc(C#N)ccc2s1)c1ccc(O[C@H]2C[C@@H](C)N(C(=O)OC(C)(C)C)C2)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.39
F10 P00742 5/20 0.35
F2 P00734 3/20 0.35
PIK3CD O00329 1/20 0.34
AR P10275 1/20 0.32
MCL1 Q07820 6/20 0.32
ACACB O00763 2/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32

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
SCHEMBL7385395 0.86 GPR119 (0.56) GPR119F10F2
SCHEMBL7387812 0.82 GPR119 (0.41) GPR119
SCHEMBL8472255 0.82 GPR119 (0.39) GPR119PIK3CDARMCL1GRIN1
SCHEMBL7385828 0.81 GPR119 (0.50) GPR119F10F2PIK3CD
Hydrochloric Acid SCHEMBL7386612 0.80 F10 (0.43) F10F2ACACBGRIN1GRIN2B
SCHEMBL7387070 0.79 GPR119 (0.34) GPR119F10F2
SCHEMBL7390384 0.77 F10 (0.40) F10F2ACACB
SCHEMBL7379068 0.77 F10 (0.51) GPR119F10F2MCL1
SCHEMBL7379072 0.77 GPR119 (0.37) GPR119F10F2MCL1
SCHEMBL7385008 0.77 F10 (0.47) GPR119F10F2MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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