SCHEMBL8694908

SCHEMBL8694908

CC(=O)SCC([C]=O)Cc1ccc(F)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
DPP4 P27487 2/20 0.36
RIPK1 Q13546 1/20 0.35
DPP7 Q9UHL4 1/20 0.34
POLB P06746 1/20 0.34
PIN1 Q13526 1/20 0.33
MME P08473 3/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ACE P12821 2/20 0.32
CPA1 P15085 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
PSMB1 P20618 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB2 P49721 1/20 0.31

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
SCHEMBL8695484 0.82 SLC1A1 (0.44) MAOAMAOBALDH1A1LMNADPP4
SCHEMBL8697750 0.81 CYP4F2 (0.33) DPP4MMECYP4F2CYP4A11ACE
SCHEMBL8861668 0.79 CPB2 (0.42) MAOAMAOBDPP4PIN1MME
SCHEMBL8695731 0.79 CPB2 (0.42) MAOAMAOBDPP4PIN1MME
SCHEMBL27337151 0.78 MME (0.49) POLBMMEACE
SCHEMBL8694913 0.78 MAOA (0.38) MAOAMAOBALDH1A1LMNADPP4
SCHEMBL8692729 0.77 NPC1 (0.40) ALDH1A1LMNAPOLBACE
SCHEMBL8697115 0.76 ACACB (0.44) ALDH1A1LMNA
SCHEMBL8410291 0.76 HRH4 (0.51) ALDH1A1LMNAACE
SCHEMBL8692217 0.76 LDHA (0.50) POLB

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