SCHEMBL5513690

SCHEMBL5513690

CNc1c(F)ccc2c(O)c(F)c(F)cc12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
HSD17B3 P37058 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
SCHEMBL5518869 0.83
SCHEMBL5511694 0.81 ADRA2A (0.33) ADRA2AADRA2BADRA2C
SCHEMBL5512099 0.79
SCHEMBL5511753 0.77 IDO1 (0.42)
SCHEMBL5514314 0.77 CA3 (0.34) HSD17B3
SCHEMBL5511625 0.76 ADRA2A (0.31) ADRA2AADRA2BADRA2C
SCHEMBL5507115 0.74 RAPGEF4 (0.34)
SCHEMBL5516451 0.72 ADRA2A (0.36) ADRA2AADRA2BADRA2C
SCHEMBL5508766 0.72 HSD17B1 (0.33)
SCHEMBL5520165 0.71

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
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed