SCHEMBL8019384

SCHEMBL8019384

Cc1cc(C)c(CC(=O)C2CC(=O)CC2C(=O)O)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 2/20 0.36
GRIK2 Q13002 1/20 0.33
RECQL P46063 1/20 0.33
P2RX7 Q99572 1/20 0.33
NR2F2 P24468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
GPR17 Q13304 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL8005995 0.89 GAA (0.35) POLBMAPTKDM4EGRIK2RECQL
SCHEMBL8703408 0.84 MMP2 (0.34) POLBMAPTKDM4EP2RX7NR2F2
SCHEMBL1225501 0.83 KDM4E (0.40) POLBMAPTKDM4EP2RX7MEN1
SCHEMBL12885645 0.83 KDM4E (0.40) POLBMAPTKDM4EP2RX7MEN1
SCHEMBL8017376 0.83 KDM4E (0.39) POLBMAPTKDM4EGRIK2P2RX7
SCHEMBL8022788 0.80 GAA (0.43) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL8019369 0.79 POLB (0.36) POLBMAPTKDM4EGRIK2ALDH1A1
SCHEMBL8021762 0.79 CA1 (0.42) POLBMAPTKDM4EGRIK2P2RX7
SCHEMBL8019429 0.79 KDM4E (0.36) POLBMAPTKDM4EGRIK2ALDH1A1
SCHEMBL8005992 0.77 KDM4E (0.35) POLBMAPTKDM4EGRIK2P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773920-B1 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AG (DE) 2000-01-26 EP disclosed
US-5808135-A HERBICIDE; PESTICIDE BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed
EP-0773920-A1 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AG (DE) 1997-05-21 EP disclosed
WO-1996003366-A1 2-(2,4,6-TRIMETHYL PHENYL)CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1996-02-08 WO disclosed