SCHEMBL8071769

SCHEMBL8071769

CCC(C)(C1C(C)=Cc2c(-c3ccc4ccccc4c3)cccc21)C1C(C)=Cc2c(-c3ccc4ccccc4c3)cccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.35
HSD11B1 P28845 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
CNR2 P34972 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
SLC22A12 Q96S37 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8068287 0.84 PDCD1 (0.34)
SCHEMBL8074043 0.81 PPARG (0.35) SLC6A4CNR2SLC22A12ALDH1A1HPGD
Hydrochloric Acid SCHEMBL29612316 0.77 GSTP1 (0.38) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL5952828 0.77 GSTP1 (0.38) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
SCHEMBL7940308 0.77 GSTP1 (0.44) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
SCHEMBL7920409 0.77 GSTP1 (0.36) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL7601708 0.76 GSTP1 (0.39) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
SCHEMBL6234917 0.75 GSTP1 (0.36) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
SCHEMBL3159292 0.74 GSTP1 (0.38) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3
SCHEMBL28941567 0.74 GSTP1 (0.38) GSTP1HSD11B1SLC6A2SLC6A4SLC6A3

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