SCHEMBL7781016

SCHEMBL7781016

Cc1ccc(C2C(=O)NC(C)(C3CC3)C2=O)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.36
CRBN Q96SW2 2/20 0.36
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
BRCA1 P38398 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 2/20 0.33
CYP3A4 P08684 1/20 0.33
PBRM1 Q86U86 1/20 0.33
MGLL Q99685 3/20 0.32
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GRM7 Q14831 1/20 0.31
IDO1 P14902 2/20 0.31

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
SCHEMBL8560146 0.86 ALDH1A1 (0.32) DDB1CRBNALDH1A1CYP3A4NOS3
SCHEMBL6998330 0.84 CA2 (0.38) DDB1CRBNALDH1A1HPGDHSD17B10
SCHEMBL7780291 0.81 CRBN (0.33) DDB1CRBNKMT2AHSD17B10L3MBTL1
SCHEMBL8906325 0.77 THRB (0.43) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL8863053 0.76 KMT2A (0.42) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL7769002 0.76 KMT2A (0.42) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL7766420 0.76 ALDH1A1 (0.35) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL7781028 0.76 HTR7 (0.32) CRBN
SCHEMBL3596041 0.75 KMT2A (0.33) CRBNKMT2A
SCHEMBL8863015 0.74 MEN1 (0.35) DDB1CRBNALDH1A1MEN1KMT2A

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-0613885-B1 Subsituted 1-H-3-phenyl-5-cycloalkyl-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides BAYER AG (DE) 2001-09-19 EP disclosed
US-5567671-A HERBICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-10-22 US disclosed
EP-0613885-A2 Subsituted 1-H-3-phenyl-5-cycloalkyl-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides BAYER AG (DE) 1994-09-07 EP disclosed