SCHEMBL5721202

SCHEMBL5721202

CCCCC1=Cc2c(ccc(CCC)c2-c2ccccc2CC)[CH]1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.32
CTSG P08311 2/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
LIPG Q9Y5X9 1/20 0.31
TLR8 Q9NR97 1/20 0.30
PTPN1 P18031 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
SCHEMBL5721305 0.95 ELANE (0.33) ELANECTSGNR1H2NR1H3LIPG
SCHEMBL5721699 0.93 ELANE (0.32) ELANECTSG
SCHEMBL5721519 0.91 ELANE (0.32) ELANECTSG
SCHEMBL5721719 0.89 PDK2 (0.31) ELANECTSG
SCHEMBL5721177 0.87 TLR8 (0.33) NR1H2NR1H3LIPGTLR8PTPN1
SCHEMBL5721606 0.86 PSMB5 (0.33) PTPN1
SCHEMBL5721690 0.85 PSMB5 (0.33) ELANECTSGNR1H2NR1H3
SCHEMBL5721361 0.85 PPARA (0.30)
SCHEMBL5721708 0.84 PTPN1 (0.31) PTPN1
SCHEMBL5610318 0.84 PSMB5 (0.33) ELANECTSGPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1640377-A1 Metallocenes and catalyst compositions derived therefrom Exxonmobil Chemical Patents Inc. (US) 2006-03-29 EP disclosed