SCHEMBL28210368

SCHEMBL28210368

CCCOS(C)(=O)=O.[CH2]CO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
USP2 O75604 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MMP9 P14780 1/20 0.50
ALOX15 P16050 1/20 0.50
CA1 P00915 11/20 0.46
CA2 P00918 11/20 0.46
CA9 Q16790 8/20 0.32
CA12 O43570 3/20 0.31
CA7 P43166 3/20 0.31
CA14 Q9ULX7 3/20 0.31
CA3 P07451 2/20 0.31
CA4 P22748 2/20 0.31
CA6 P23280 2/20 0.31
CA5A P35218 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
RECQL P46063 2/20 0.30
GLA P06280 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
Alcohol SCHEMBL16767380 0.90 TSHR (0.55) TSHRUSP2KDM4EALDH1A1LMNA
SCHEMBL502063 0.87
Ammonia Solution, Strong SCHEMBL27877380 0.85
SCHEMBL28114061 0.85
SCHEMBL28190363 0.85
Hydrochloric Acid SCHEMBL4784695 0.85
SCHEMBL4669189 0.85
Ammonia Solution, Strong SCHEMBL28875590 0.82 TSHR (0.57) TSHRUSP2KDM4EALDH1A1LMNA
Acrylamide SCHEMBL20543082 0.77 CA2 (0.43) TSHRUSP2KDM4EALDH1A1LMNA
SCHEMBL28050947 0.77 TDP1 (0.46) TSHRUSP2KDM4EALDH1A1LMNA

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
CN-105102570-B Adhesive composition and adhesive film using the same 大日本印刷株式会社 2018-04-03 CN disclosed