SCHEMBL8695484

SCHEMBL8695484

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

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.44
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
MAOB P27338 3/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
DPP4 P27487 2/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GFER P55789 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MME P08473 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
MAOA P21397 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
SCHEMBL8697750 0.86 CYP4F2 (0.33) DPP4MME
SCHEMBL27337151 0.83 MME (0.49) CTSSCTSKPPARAMME
SCHEMBL8694908 0.82 MAOA (0.38) MAOBDPP4DPP7ALDH1A1LMNA
SCHEMBL8694883 0.80 SLC1A1 (0.51) SLC1A1PPARGPPARAMEN1KMT2A
SCHEMBL8861583 0.80 SLC1A1 (0.51) SLC1A1PPARGPPARAMEN1KMT2A
SCHEMBL8695487 0.78 SLC1A1 (0.44) SLC1A1MAOBPPARGPPARAMEN1
SCHEMBL8702372 0.75 SLC1A1 (0.44) SLC1A1CTSSCTSKPPARGPPARA
SCHEMBL8695465 0.75 ACACB (0.45) PPARGPPARAMME
SCHEMBL8692729 0.74 NPC1 (0.40) PPARGPPARAALDH1A1LMNA
SCHEMBL8410291 0.73 HRH4 (0.51) ALDH1A1LMNATAAR1

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