SCHEMBL8558450

SCHEMBL8558450

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 9/20 0.42
P2RX7 Q99572 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
LMNA P02545 1/20 0.38
ANO2 Q9NQ90 1/20 0.38
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
HTR2A P28223 1/20 0.36
PMP22 Q01453 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
SCHEMBL4435109 0.88 KMT2A (0.43) ANO1L3MBTL1GAAALDH1A1KDM4E
SCHEMBL8559264 0.88 ANO1 (0.43) ANO1P2RX7L3MBTL1POLBGAA
SCHEMBL8862726 0.88 P2RX7 (0.39) P2RX7ALDH1A1KDM4EHTT
SCHEMBL6997846 0.85 MEN1 (0.41) ANO1ALDH1A1
SCHEMBL8651766 0.83 P2RX7 (0.47) ANO1P2RX7L3MBTL1ALDH1A1KDM4E
SCHEMBL8552873 0.83 ALDH1A1 (0.38) ANO1L3MBTL1ALDH1A1KDM4EHTT
SCHEMBL8654003 0.81 P2RX7 (0.43) ANO1P2RX7L3MBTL1POLBGAA
SCHEMBL4428397 0.81 MEN1 (0.42) ANO1P2RX7L3MBTL1ALDH1A1KDM4E
SCHEMBL8862719 0.81 P2RX7 (0.37) P2RX7L3MBTL1GAAALDH1A1KDM4E
SCHEMBL8862619 0.79 SMN1; SMN2 (0.42) P2RX7GAAALDH1A1CYP1A2CYP3A4

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