SCHEMBL7280689

SCHEMBL7280689

COC(=O)C(N)Cc1ccccc1OCCCCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.51
YAP1 P46937 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PKM P14618 1/20 0.46
TGFBR1 P36897 1/20 0.44
HTR6 P50406 1/20 0.43
FAAH O00519 1/20 0.42
SCN9A Q15858 1/20 0.42
DPP4 P27487 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL7279210 0.88 GPR119 (0.49) GPR119YAP1KDM4EPKMTGFBR1
SCHEMBL7280692 0.83 GPR119 (0.62) GPR119YAP1FAAH
SCHEMBL7280338 0.83 GPR119 (0.51) GPR119YAP1TGFBR1HTR6
SCHEMBL7282950 0.83 STS (0.52) GPR119YAP1KDM4EPKMTGFBR1
SCHEMBL7280754 0.82 GPR119 (0.48) GPR119YAP1TGFBR1HTR6SCN9A
SCHEMBL7413655 0.82 GPR119 (0.57) GPR119KDM4EPKMTGFBR1HTR6
SCHEMBL7416311 0.81 GPR119 (0.56) GPR119KDM4EPKMTGFBR1HTR6
SCHEMBL7279787 0.80 ITGB3 (0.47) GPR119YAP1TGFBR1HTR6SCN9A
SCHEMBL7273552 0.79 YAP1 (0.48) GPR119YAP1
SCHEMBL7442789 0.78 STS (0.51) GPR119YAP1KDM4EPKMHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6040317-A AN ANTIAGGLOMERANTS USEFUL IN THE PREVENTION AND TREATMENT OF DISEASES CAUSED BY THROMBUS FORMATION MERCK & CO., INC. (US) 2000-03-21 US disclosed
EP-0743302-B1 Sulfonamide fibrinogen receptor antagonists MERCK & CO INC (US) 1999-08-04 EP disclosed
US-5658929-A ANTICOAGULANTS MERCK & CO., INC. (US) 1997-08-19 US disclosed
EP-0478363-B1 Novel sulfonamide fibrinogen receptor antagonists MERCK & CO INC (US) 1997-03-19 EP disclosed
EP-0743302-A2 Sulfonamide fibrinogen receptor antagonists MERCK & CO. INC. (US) 1996-11-20 EP disclosed
US-5292756-A Novel sulfonamide fibrinogen receptor antagonists MERCK & CO., INC. (US) 1994-03-08 US disclosed
WO-1993019046-A1 NOVEL SULFONAMIDE FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1993-09-30 WO disclosed
EP-0478363-A2 Novel sulfonamide fibrinogen receptor antagonists MERCK & CO. INC. (US) 1992-04-01 EP disclosed