SCHEMBL17415228

SCHEMBL17415228

CC1=Cc2c(C(C)C)cccc2C1[Hf](C)(C)(=[SiH2])C1C(C)=Cc2c(C(C)C)cccc21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.32
GABRG2 P18507 2/20 0.32
GABRB3 P28472 2/20 0.32
FAAH O00519 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
GABRB1 P18505 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
HTR2C P28335 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
HTR2B P41595 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 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
Hydrochloric Acid SCHEMBL818812 0.98 FAAH (0.32) GABRA1GABRG2GABRB3FAAHCA1
SCHEMBL17386635 0.82 FAAH (0.31) GABRA1GABRG2GABRB3FAAHCA1
SCHEMBL17415133 0.80 SLC6A2 (0.30) SLC6A2
SCHEMBL1120746 0.80 GABRA1 (0.32) GABRA1GABRB2
SCHEMBL20590577 0.80
Hydrochloric Acid SCHEMBL819245 0.79 GABRA1 (0.31) GABRA1GABRB2
Hydrochloric Acid SCHEMBL4474251 0.79 MEN1 (0.30) HTR2C
SCHEMBL818811 0.78 LMNA (0.33) GABRA1GABRG2GABRB3FAAHCA1
SCHEMBL17386979 0.78 LMNA (0.33) GABRA1GABRG2GABRB3FAAHCA1
SCHEMBL20590606 0.77

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