SCHEMBL17415006

SCHEMBL17415006

CC(C)[Hf](C)(C)(=[SiH2])(C(C)C)(C1C=Cc2c(-c3ccc4ccccc4c3)cccc21)C1C=Cc2c(-c3ccc4ccccc4c3)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 3/20 0.37
AKR1C2 P52895 3/20 0.37
GSTP1 P09211 1/20 0.34
S1PR4 O95977 3/20 0.33
S1PR5 Q9H228 3/20 0.33
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
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
SOS1 Q07889 1/20 0.32
HIF1A Q16665 1/20 0.32
MET P08581 1/20 0.31
EDNRB P24530 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
SCHEMBL17415040 0.88 GSTP1 (0.37) AKR1C3AKR1C2GSTP1S1PR4S1PR5
SCHEMBL17416098 0.86 CHRNB2 (0.30)
SCHEMBL17415100 0.85 BRD4 (0.32)
SCHEMBL17415031 0.84 RXRA (0.35)
SCHEMBL17415951 0.83 GSTP1 (0.34) AKR1C3AKR1C2GSTP1S1PR4S1PR5
SCHEMBL17414889 0.83 AKR1C3 (0.36) AKR1C3AKR1C2TSHRMET
SCHEMBL17415125 0.83
SCHEMBL17415233 0.83 EDNRB (0.31) EDNRBEDNRA
SCHEMBL17415467 0.82 ABL1 (0.35) HDAC4HDAC2HDAC8CYP2C9TSHR
SCHEMBL17415325 0.81 HTR1A (0.32) EDNRBEDNRA

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-2966096-B1 METHOD FOR PRODUCING ETHYLENE/ -OLEFIN COPOLYMER JAPAN POLYETHYLENE CORP (JP) 2017-04-26 EP disclosed
EP-2966096-A1 METHOD FOR PRODUCING ETHYLENE/ -OLEFIN COPOLYMER Japan Polyethylene Corporation (JP) 2016-01-13 EP disclosed