SCHEMBL8695487

SCHEMBL8695487

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

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.44
MAOB P27338 4/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GFER P55789 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
MME P08473 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
MAOA P21397 1/20 0.37
MDM2 Q00987 1/20 0.37

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
SCHEMBL8697753 0.86 EPHX1 (0.33) MME
SCHEMBL27889030 0.83 MME (0.49) PPARAMEN1KMT2AMMETAAR1
SCHEMBL8694913 0.82 MAOA (0.38) MAOBMMEMAOA
SCHEMBL8694883 0.80 SLC1A1 (0.51) SLC1A1PPARGPPARAMEN1KMT2A
SCHEMBL8861583 0.80 SLC1A1 (0.51) SLC1A1PPARGPPARAMEN1KMT2A
SCHEMBL8695484 0.78 SLC1A1 (0.44) SLC1A1MAOBPPARGPPARAMEN1
SCHEMBL8702373 0.75 SLC1A1 (0.44) SLC1A1MAOBPPARGPPARAHCAR2
SCHEMBL8695470 0.75 SRR (0.42) PPARGPPARAMME
SCHEMBL19812679 0.73 TAAR1 (0.50) SLC1A1MAOBPPARGPPARAHCAR2
SCHEMBL8692220 0.72 LDHA (0.50) PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5846956-A Amino acids derivatives, the process for their preparation and their applications to therapy SOCIETE CIVILE BIOPROJET (FR) 1998-12-08 US disclosed
US-5670531-A ENKEPHALINASE OR ANGIOTENSIN CONVERTING ENZYME INHIBITORS SOCIETE CIVILE BIOPROJET (FR) 1997-09-23 US disclosed