SCHEMBL8556633

SCHEMBL8556633

CCC(C)C(C)(NC(=O)Cc1ccc(Cl)cc1C)C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
P2RX7 Q99572 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ANO1 Q5XXA6 6/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
HTT P42858 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
LPAR1 Q92633 1/20 0.36
ANO2 Q9NQ90 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL4428398 0.89 TAS1R3 (0.46) TAS1R3TAS1R1ANO1ALDH1A1KDM4E
SCHEMBL8862522 0.88 TAS1R3 (0.49) TAS1R3TAS1R1P2RX7ALDH1A1KDM4E
SCHEMBL8558179 0.88 P2RX7 (0.41) P2RX7L3MBTL1ANO1ALDH1A1KDM4E
SCHEMBL6998326 0.86 TAS1R3 (0.47) TAS1R3TAS1R1ANO1ALDH1A1
SCHEMBL8558779 0.84 TAS1R3 (0.47) TAS1R3TAS1R1L3MBTL1ALDH1A1KDM4E
SCHEMBL4425768 0.82 TAS1R3 (0.46) TAS1R3TAS1R1P2RX7L3MBTL1ANO1
SCHEMBL8651766 0.81 P2RX7 (0.47) P2RX7L3MBTL1ANO1ALDH1A1KDM4E
SCHEMBL8862570 0.80 TAS1R3 (0.41) TAS1R3TAS1R1P2RX7ALDH1A1KDM4E
SCHEMBL4434739 0.80 LPAR1 (0.44) L3MBTL1ANO1ALDH1A1KDM4ELPAR1
SCHEMBL8654003 0.79 P2RX7 (0.43) P2RX7L3MBTL1ANO1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847211-A Substituted 1H-3-Aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-12-08 US disclosed
EP-0668267-B1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1998-04-08 EP disclosed
US-5622917-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
EP-0668267-A1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1995-08-23 EP disclosed