SCHEMBL27404993

SCHEMBL27404993

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
TGFBR1 P36897 1/20 0.34
ALDH1A1 P00352 1/20 0.31
SLC7A5 Q01650 1/20 0.31
TP53 P04637 1/20 0.30
FFAR3 O14843 1/20 0.30
LCK P06239 1/20 0.30
FYN P06241 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
SCHEMBL6235942 0.72 TDP1 (0.38) TDP1TGFBR1ALDH1A1SLC7A5TP53
SCHEMBL21598896 0.71 LMNA (0.32) TDP1ALDH1A1TP53
SCHEMBL1361252 0.71
SCHEMBL817685 0.70 TP53 (0.38) TDP1TGFBR1ALDH1A1SLC7A5TP53
SCHEMBL11352448 0.70 TDP1 (0.36) TDP1ALDH1A1
SCHEMBL2821316 0.70 TP53 (0.38) TDP1TGFBR1ALDH1A1SLC7A5TP53
SCHEMBL426441 0.69
SCHEMBL27974225 0.68 SLC7A5 (0.42) TDP1TGFBR1ALDH1A1SLC7A5TP53
SCHEMBL18140092 0.68 TDP1 (0.36) TDP1TGFBR1ALDH1A1SLC7A5TP53
Propene SCHEMBL23068720 0.67 LMNA (0.35) ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1079799-C Encapsulated hydrophilic polymers and their preparation ROHM & HAAS (US) 2002-02-27 CN claimed
CN-1130634-A Encapsulated hydrophilic polymers and their preparation ROHM & HAAS (US) 1996-09-11 CN claimed
CN-1182763-A Low glass coating composition ROHM & HAAS (US) 1998-05-27 CN disclosed