SCHEMBL7390604

SCHEMBL7390604

CCOC(=O)CCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1CCc1cc2cc(C#N)ccc2s1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.46
ALK Q9UM73 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
F10 P00742 1/20 0.37
CETP P11597 2/20 0.36
PIK3CD O00329 2/20 0.34
PIK3CA P42336 1/20 0.34
BTK Q06187 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
SCHEMBL7391018 0.90 GPR119 (0.40) GPR119KDM4EALDH1A1GLAHPGD
SCHEMBL8470397 0.84 GPR119 (0.50) GPR119ALKCETP
SCHEMBL7387156 0.82 GPR119 (0.48) GPR119ALKHPGDF10CETP
SCHEMBL8469683 0.81 GPR119 (0.57) GPR119ALKCETP
SCHEMBL7389406 0.80 GPR119 (0.46) GPR119ALKF10CETPPIK3CD
SCHEMBL7389408 0.80 GPR119 (0.46) GPR119ALKCETPPIK3CDPIK3CA
SCHEMBL8469556 0.79 GPR119 (0.51) GPR119ALKCETP
SCHEMBL7382020 0.79 CLK1 (0.40) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7390133 0.76 GPR119 (0.50) GPR119ALKCETPBTK
SCHEMBL7390135 0.76 GPR119 (0.50) GPR119ALKCETPBTK

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