SCHEMBL29322166

SCHEMBL29322166

C=C(C)C(=O)OCCOC(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.48
MMP3 P08254 6/20 0.48
MAPT P10636 3/20 0.45
ALDH1A1 P00352 1/20 0.45
MMP1 P03956 1/20 0.44
MMP9 P14780 1/20 0.44
MMP13 P45452 1/20 0.44
POLB P06746 2/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HRH2 P25021 2/20 0.41
HRH1 P35367 2/20 0.41
HRH3 Q9Y5N1 2/20 0.41
MGLL Q99685 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL29316176 0.95 POLB (0.47) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29322190 0.95 POLB (0.50) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29316183 0.94 POLB (0.52) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29322204 0.94 POLB (0.52) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL7578689 0.88 MAPT (0.58) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29322212 0.88 MMP2 (0.49) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29316185 0.86 MMP2 (0.50) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL29316152 0.86 MMP2 (0.49) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL25123515 0.85 MAPT (0.55) MMP2MMP3MAPTALDH1A1MMP1
SCHEMBL10035132 0.85 MAPT (0.55) MMP2MMP3MAPTALDH1A1MMP1

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-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed