SCHEMBL8863015

SCHEMBL8863015

CCC1(CC)NC(=O)C(c2ccc(C)cc2C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 2/20 0.35
ALOX12 P18054 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
BRCA1 P38398 1/20 0.35
PBRM1 Q86U86 1/20 0.34
GRM7 Q14831 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
DDB1 Q16531 1/20 0.33
CRBN Q96SW2 1/20 0.33
LMNA P02545 2/20 0.32
MGLL Q99685 3/20 0.31
GAA P10253 2/20 0.31
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 1/20 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
SCHEMBL8862581 0.89 MEN1 (0.34) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL8554454 0.86 CACNB4 (0.35) ALDH1A1HPGDKDM4ELMNAGAA
SCHEMBL8863034 0.79 MEN1 (0.33) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL8862650 0.77 MEN1 (0.36) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL7766420 0.75 ALDH1A1 (0.35) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL8863053 0.75 KMT2A (0.42) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL7769002 0.75 KMT2A (0.42) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL8862627 0.75 ALDH1A1 (0.33) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL7781016 0.74 DDB1 (0.36) MEN1KMT2AALDH1A1ALOX12HSD17B10
SCHEMBL8906325 0.73 THRB (0.43) MEN1KMT2AALDH1A1ALOX12HSD17B10

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
US-5602078-A POSSESS HERBICIDAL AND PESTICIDAL ACTIVITY BAYER AKTIENGESELLSCHAFT (DE) 1997-02-11 US disclosed
US-5504057-A HERBICIDES; PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-04-02 US disclosed
EP-0613884-A2 Dialkyl-1-H-3(2,4-dimethylphenyl)-pyrrolidin-2,4-diones, their preparation and their use as parasiticides and herbicides BAYER AG (DE) 1994-09-07 EP disclosed