SCHEMBL6232525

SCHEMBL6232525

CC(C)c1c(O)c(O)cc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.44
BCL2L1 Q07817 1/20 0.44
MCL1 Q07820 1/20 0.44
BCL2L2 Q92843 1/20 0.44
GABRA1 P14867 4/20 0.39
GABRB2 P47870 2/20 0.39
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ADRB2 P07550 3/20 0.34
ADRB1 P08588 2/20 0.34
ADRB3 P13945 2/20 0.34
SELL P14151 1/20 0.33
SELP P16109 1/20 0.33
SELE P16581 1/20 0.33
AHR P35869 1/20 0.33
ADRA2A P08913 2/20 0.32
ADRA2B P18089 2/20 0.32
ADRA2C P18825 2/20 0.32
ADRA1A P35348 2/20 0.32
CYP3A4 P08684 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
SCHEMBL19769008 0.86 BCL2 (0.36) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL19768999 0.81 HSD17B10 (0.40) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL19769043 0.81 GABRA1 (0.38) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL19779805 0.78 BCL2 (0.32) BCL2BCL2L1MCL1BCL2L2
SCHEMBL9003976 0.78 CA1 (0.33) CA1CA2
SCHEMBL19768986 0.77 TRPV4 (0.36) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL5587657 0.75 LDHA (0.33) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL15743959 0.74 BCL2 (0.46) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL20780498 0.74 GABRA1 (0.45) BCL2BCL2L1MCL1BCL2L2GABRA1
SCHEMBL22561829 0.73 CA1 (0.31) CA1CA2

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-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed