SCHEMBL8633268

SCHEMBL8633268

COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1C(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
PDK2 Q15119 1/20 0.49
ALOX5 P09917 1/20 0.49
KMT2A Q03164 1/20 0.49
ACE P12821 1/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
LOX P28300 1/20 0.47
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LTA4H P09960 2/20 0.44

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
SCHEMBL8637778 0.87 ROCK2 (0.47) KMT2AACEGAASMN1; SMN2
SCHEMBL9871506 0.87 KMT2A (0.59) PDK2ALOX5KMT2AACENPC1
SCHEMBL24435015 0.87 KMT2A (0.59) PDK2ALOX5KMT2AACENPC1
SCHEMBL10724171 0.87 CNR1 (0.53) CNR1CNR2PDK2ALOX5KMT2A
SCHEMBL1762519 0.87 KMT2A (0.59) PDK2ALOX5KMT2AACENPC1
SCHEMBL13468539 0.84 CNR1 (0.53) CNR1CNR2PDK2ALOX5KMT2A
SCHEMBL12979193 0.83 CNR1 (0.53) CNR1CNR2PDK2ALOX5NPC1
SCHEMBL31562993 0.83 CNR1 (0.53) CNR1CNR2PDK2ALOX5NPC1
SCHEMBL3579233 0.83 NPC1 (0.57) CNR2PDK2KMT2ANPC1RAB9A
SCHEMBL3579235 0.83 NPC1 (0.57) CNR2PDK2KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847155-A Aromatic pyrrolidine amide prolyl endopeptidase inhibitors PFIZER INC (US) 1998-12-08 US disclosed
EP-0536163-A1 AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES PFIZER INC. (US) 1993-04-14 EP disclosed
WO-1991018891-A1 AROMATIC PYRROLIDINE AND THIAZOLIDINE AMIDES PFIZER INC. (US) 1991-12-12 WO disclosed