SCHEMBL8555896

SCHEMBL8555896

COC(=O)[C@H](C)NC(=O)Cc1ccc(Cl)cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
LMNA P02545 2/20 0.55
GAA P10253 1/20 0.49
PTGS2 P35354 2/20 0.47
RECQL P46063 2/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 4/20 0.44
NPSR1 Q6W5P4 2/20 0.44
P2RX7 Q99572 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ANO1 Q5XXA6 2/20 0.40
LPAR1 Q92633 1/20 0.40

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
SCHEMBL8654991 1.00 MEN1 (0.55) MEN1KMT2ALMNAGAAPTGS2
SCHEMBL8657482 0.87 ALDH1A1 (0.57) MEN1KMT2ALMNAGAAALDH1A1
SCHEMBL8557162 0.87 ALDH1A1 (0.57) MEN1KMT2ALMNAGAAALDH1A1
SCHEMBL8554539 0.86 SHMT1 (0.50) GAATSHRALDH1A1P2RX7HDAC3
SCHEMBL8554540 0.86 SHMT1 (0.50) GAATSHRALDH1A1P2RX7HDAC3
SCHEMBL8654231 0.86 NOS3 (0.52) MEN1KMT2ALMNA
SCHEMBL8555850 0.86 NOS3 (0.52) MEN1KMT2ALMNA
SCHEMBL4429507 0.85 LPAR1 (0.50) MEN1KMT2ALMNAGAAPTGS2
SCHEMBL6485648 0.85 LPAR1 (0.50) MEN1KMT2ALMNAGAAPTGS2
SCHEMBL6995409 0.85 MEN1 (0.50) MEN1KMT2APTGS2RECQLTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1080719-C Substituted 1H-3-aryl-pyrrolidine-2,4-diones derivative BAYER GMBH (DE) 2002-03-13 CN disclosed
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
CN-1110680-A Substituted 1H-3-aryl-pyrrolidine-2,4-diones derivative BYLL GMBH (DE) 1995-10-25 CN disclosed
EP-0668267-A1 Substituted 1H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AG (DE) 1995-08-23 EP disclosed