SCHEMBL7367564

SCHEMBL7367564

Cc1nc(NC(=O)[C@@H](NC(=O)N(O)C(=O)[C@@H](O)CCC(C)C)C(C)(C)C)sc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.39
HSPA5 P11021 1/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
RAB9A P51151 6/20 0.35
NPC1 O15118 5/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
HSPA8 P11142 1/20 0.34
HSPA2 P54652 1/20 0.34
RXFP1 Q9HBX9 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PIK3CG P48736 1/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL7402956 0.85 POLB (0.45) SMN1; SMN2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL7378206 0.80 FFAR2 (0.43) FFAR2PSEN1PSEN2APH1BNCSTN
SCHEMBL7410116 0.80 HSPA5 (0.51) FFAR2HSPA5HSPA8HSPA2MEN1
SCHEMBL8777490 0.77 POLB (0.38) POLB
SCHEMBL7513209 0.77 MMP1 (0.44)
SCHEMBL6435917 0.77 POLB (0.38) POLB
SCHEMBL7370348 0.76 MMP2 (0.46) FFAR2SMN1; SMN2HTT
SCHEMBL7410121 0.76 MMP2 (0.47) RAB9ANPC1SMN1; SMN2GAAMAPT
SCHEMBL7373809 0.74 MMP1 (0.56) FFAR2RAB9ASMN1; SMN2GAAALDH1A1
SCHEMBL7371393 0.73 RAB9A (0.43) FFAR2RAB9ANPC1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0740652-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1998-05-06 EP claimed
US-5919940-A TERT-LEUCINE-THIAZOL-2-YLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-07-06 US disclosed
US-5859253-A L-TERT-LEUCINE-2-PYRIDYLAMIDE BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-01-12 US disclosed
EP-0740652-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1998-05-06 EP disclosed
US-5747514-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1998-05-05 US disclosed
EP-0740652-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019956-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed