SCHEMBL8744701

SCHEMBL8744701

Cc1cc(C)c(C2C(=O)NC(CC(C)C)C2=O)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.32
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PBRM1 Q86U86 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
PAX8 Q06710 1/20 0.30
MMP1 P03956 1/20 0.30
MMP3 P08254 1/20 0.30

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
SCHEMBL8648444 0.76 PBRM1 (0.32) MEN1KMT2APBRM1
SCHEMBL12687656 0.72 ACHE (0.35)
SCHEMBL16433665 0.72 ALDH1A1 (0.32) MEN1KMT2A
SCHEMBL12687654 0.70 BCHE (0.30)
SCHEMBL8744823 0.70 TAS1R3 (0.32) KDM4EMEN1KMT2APBRM1
SCHEMBL2867325 0.68 MEN1 (0.41) VDRMEN1KMT2AGAAHTT
SCHEMBL163425 0.68 MEN1 (0.41) VDRMEN1KMT2AGAAHTT
SCHEMBL12687865 0.67 MEN1 (0.32) KDM4EMEN1KMT2AHTT
SCHEMBL20392736 0.67
SCHEMBL8744726 0.67 USP2 (0.36) KDM4EMEN1KMT2APBRM1GAA

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