SCHEMBL7961908

SCHEMBL7961908

CC(=O)C(O)C(N)Cc1cccc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.55
DPP4 P27487 3/20 0.44
DPP7 Q9UHL4 2/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP9 Q86TI2 1/20 0.44
ROCK1 Q13464 1/20 0.43
MAOB P27338 2/20 0.43
ROCK2 O75116 1/20 0.42
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.42
TAAR1 Q96RJ0 1/20 0.41
LAP3 P28838 2/20 0.41
ANPEP P15144 1/20 0.41
RNPEP Q9H4A4 1/20 0.41
DNPEP Q9ULA0 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40

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
SCHEMBL22885989 0.86 SLC1A1 (0.56) SLC1A1DPP4DPP7DPP8DPP9
SCHEMBL7959519 0.86 SLC1A1 (0.64) SLC1A1DPP4DPP7DPP8DPP9
SCHEMBL7950570 0.86 SLC1A1 (0.43) SLC1A1DPP4DPP7DPP8DPP9
SCHEMBL21417397 0.84 SLC1A1 (0.60) SLC1A1DPP4DPP7DPP8DPP9
SCHEMBL10069421 0.84 SLC1A1 (0.60) SLC1A1DPP4DPP7DPP8DPP9
SCHEMBL7950672 0.83 TAAR1 (0.42) MAOBTAAR1LAP3ANPEPRNPEP
SCHEMBL27481126 0.83 NOS1 (0.44) LAP3ANPEPRNPEPDNPEPNOS3
SCHEMBL7951057 0.82 PNMT (0.58) MAOBTAAR1LAP3ANPEPRNPEP
SCHEMBL7950513 0.81 TRPA1 (0.47) DPP4DPP7DPP8DPP9LAP3
SCHEMBL6321788 0.80 ALPI (0.58) SLC1A1TAAR1LAP3ANPEPRNPEP

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
CN-1169791-C Novel acetamide derivatives and protease inhibitors �ձ���ҩ��ʽ���� 2004-10-06 CN disclosed
US-6271238-B1 USEFUL IN TREATING AND PREVENTING DISEASES INVOLVING CHYMOTRYPSIN TYPE PROTEASES WHICH ARE RELATED TO ASTHMA, ALLERGY, INFLAMMATIONS, RHEUMATISM, HYPERTENSION, HEART FAILURE, MYOCARDIAL INFARCTION, AND CARDIAC HYPERTROPHY NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-08-07 US disclosed
CN-1229405-A Novel acetamide derivatives and protease inhibitors NIPPON KAYAKU KK (JP) 1999-09-22 CN disclosed
EP-0936216-A1 NOVEL ACETAMIDE DERIVATIVES AND PROTEASE INHIBITORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1999-08-18 EP disclosed