SCHEMBL12346019

SCHEMBL12346019

CCOCOC(=O)C(F)(F)C(F)(F)C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
THRB P10828 2/20 0.32
PKM P14618 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HDAC4 P56524 2/20 0.30
HDAC6 Q9UBN7 2/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 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
SCHEMBL13446143 0.92 ALDH1A1 (0.37) ALDH1A1TSHRLMNAHSD17B10THRB
SCHEMBL12346016 0.85 CES2 (0.33) ALDH1A1TSHR
SCHEMBL13446141 0.85 ALDH1A1 (0.32) ALDH1A1TSHRHDAC4HDAC6HDAC3
SCHEMBL12346013 0.82 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10
SCHEMBL12346014 0.81 CES2 (0.47) ALDH1A1TSHRHSD17B10
SCHEMBL12346017 0.80 CES2 (0.50) TSHRHSD17B10
SCHEMBL12346023 0.76 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL13446144 0.76 CES2 (0.36) ALDH1A1TSHRHSD17B10
SCHEMBL4392350 0.74 ALDH1A1 (0.48) ALDH1A1LMNAHSD17B10THRBPKM
SCHEMBL13446138 0.73 CES2 (0.46) ALDH1A1TSHRHSD17B10

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
US-20110189618-A1 RESIST PROCESSING METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-04 US disclosed