SCHEMBL8635576

SCHEMBL8635576

O=CC1CSCN1C(=O)C1Cc2ccccc2N1C(=O)NCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.43
ITGA5 P08648 1/20 0.43
LMNA P02545 2/20 0.43
XIAP P98170 2/20 0.41
CACNA1G O43497 2/20 0.40
CACNA1H O95180 2/20 0.40
CACNA1I Q9P0X4 2/20 0.40
BCHE P06276 1/20 0.39
POLB P06746 1/20 0.39
PREP P48147 2/20 0.38
PKM P14618 1/20 0.38
P2RX4 Q99571 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
SCHEMBL7321743 0.73 F2 (0.50)
SCHEMBL7319764 0.72 GAA (0.47) LMNAPKM
SCHEMBL8637779 0.71 PREP (0.53) LMNAPREP
SCHEMBL20459281 0.68 LMNA (0.55) LMNAXIAPPOLB
SCHEMBL8637353 0.68 PREP (0.44) PREP
SCHEMBL7374944 0.67 PREP (0.48) BCHEPREP
SCHEMBL8634979 0.66 PREP (0.48) PREP
SCHEMBL4275949 0.65 NOTUM (0.49)
SCHEMBL7554141 0.65 NOTUM (0.49)
SCHEMBL7366403 0.64 NPC1 (0.48) BCHEPREP

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