SCHEMBL8744813

SCHEMBL8744813

CCOC(=O)[C@H](C)NC(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
PSMB5 P28074 1/20 0.40
NLRP3 Q96P20 1/20 0.39
METAP2 P50579 1/20 0.39
METAP1 P53582 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
RECQL P46063 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
SCHEMBL9595368 1.00 LMNA (0.41) LMNAPSMB5NLRP3METAP2METAP1
SCHEMBL8744786 0.85 ALDH1A1 (0.42) LMNAPSMB5NLRP3SMN1; SMN2L3MBTL1
SCHEMBL9595171 0.85 ALDH1A1 (0.42) LMNAPSMB5NLRP3SMN1; SMN2L3MBTL1
SCHEMBL8744759 0.84 KMT2A (0.42) LMNAPSMB5NLRP3
SCHEMBL8744806 0.84 TAS1R3 (0.50) LMNAL3MBTL1
SCHEMBL9593287 0.84 TAS1R3 (0.50) LMNAL3MBTL1
SCHEMBL9594066 0.84 KMT2A (0.42) LMNAPSMB5NLRP3
SCHEMBL8744760 0.83 POLB (0.47) LMNAPSMB5SMN1; SMN2L3MBTL1
SCHEMBL8744756 0.83 POLB (0.47) LMNAPSMB5SMN1; SMN2L3MBTL1
SCHEMBL8744770 0.82 PYGL (0.38) LMNAPSMB5NLRP3SMN1; SMN2L3MBTL1

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
EP-0456063-B1 1-H-3-aryl-pyrrolidin-2,4-dion-derivatives BAYER AG (DE) 1997-01-22 EP disclosed
US-5258527-A Insecticidal, acaricidal and herbicidal 1-H-3-aryl-pyrrolidine-2,4-dione derivatives BAYER AKTIENGESELLSCHAFT (DE) 1993-11-02 US disclosed
EP-0456063-A2 1-H-3-aryl-pyrrolidin-2,4-dion-derivatives BAYER AG (DE) 1991-11-13 EP disclosed