SCHEMBL8074043

SCHEMBL8074043

CCC(C)(C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21)C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
ALOX15 P16050 4/20 0.32
KDM4E B2RXH2 2/20 0.32
SLC22A12 Q96S37 1/20 0.32
CNR2 P34972 1/20 0.32
HTR7 P34969 1/20 0.32
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
SLC6A4 P31645 2/20 0.32
ALDH1A1 P00352 2/20 0.32
DRD2 P14416 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
CNR1 P21554 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
SCHEMBL7031501 0.86 SLC22A12 (0.34) PPARGPPARAKDM4ESLC22A12HTR7
SCHEMBL8068287 0.82 PDCD1 (0.34)
SCHEMBL8148892 0.82 ALDH1A1 (0.36) PPARGPPARAKDM4ESLC22A12CA12
SCHEMBL8071769 0.81 GSTP1 (0.35) PPARGPPARASLC22A12CNR2SLC6A4
SCHEMBL1453971 0.81 SLC22A12 (0.32) KDM4ESLC22A12CA12CA1CA2
SCHEMBL1453021 0.80 CA12 (0.33) KDM4ESLC22A12CA12CA1CA2
SCHEMBL17952999 0.79 ALDH1A1 (0.37) KDM4EHTR7CA12CA1CA2
Hexane SCHEMBL8604595 0.77 CNR1 (0.35) PPARGPPARAALOX15CNR2HTR7
SCHEMBL7601460 0.76 CA12 (0.32) PPARGPPARAKDM4ESLC22A12CA12
SCHEMBL7039658 0.76 ALDH1A1 (0.36) KDM4EHTR7CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1015463-A1 METHOD FOR PRODUCING METALLOCENES Basell Polyolefine GmbH (DE) 2000-07-05 EP disclosed
WO-1999012943-A1 METHOD FOR PRODUCING METALLOCENES TARGOR GMBH (DE) 1999-03-18 WO disclosed