SCHEMBL28304537

SCHEMBL28304537

C=C(C)C(=O)OCCCOC(=O)c1ccccc1C(=O)O.[H+]

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.54
TDP1 Q9NUW8 5/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
CYP3A4 P08684 3/20 0.53
MAPK1 P28482 2/20 0.53
TP53 P04637 1/20 0.53
ALDH1A1 P00352 7/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 2/20 0.50
APEX1 P27695 1/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 1/20 0.43
SCN1A P35498 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN3A Q9NY46 1/20 0.41

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
SCHEMBL194453 0.99 TSHR (0.55) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL194750 0.96 TSHR (0.58) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL36715 0.93 TSHR (0.56) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL4783599 0.93 TSHR (0.56) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL29366686 0.93 TSHR (0.56) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL645003 0.93 TSHR (0.62) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL28190689 0.91 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL2859734 0.91 TSHR (0.54) TSHRTDP1L3MBTL1CYP3A4MAPK1
Methacrylic Acid SCHEMBL14800721 0.90 TSHR (0.53) TSHRTDP1L3MBTL1CYP3A4MAPK1
SCHEMBL2532109 0.90 TSHR (0.65) TSHRTDP1L3MBTL1CYP3A4MAPK1

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-107075049-B Actinic energy ray curable resion composition, its manufacturing method, coating, film and laminate film DIC株式会社 2019-07-12 CN disclosed