SCHEMBL29323751

SCHEMBL29323751

C=C(C)C(=O)OCCCS(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
APEX1 P27695 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
TSHR P16473 2/20 0.45
HDAC1 Q13547 3/20 0.44
HDAC8 Q9BY41 2/20 0.44
HDAC2 Q92769 2/20 0.44
MAPT P10636 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
CA2 P00918 1/20 0.44
HSD11B1 P28845 3/20 0.43
PSIP1 O75475 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
SCHEMBL1130280 0.91 MAPT (0.47) POLBAPEX1HTTTDP1TSHR
SCHEMBL9555062 0.87 HTT (0.47) POLBAPEX1HTTTDP1TSHR
SCHEMBL23094333 0.87 TDP1 (0.52) POLBAPEX1HTTTDP1TSHR
SCHEMBL9555489 0.83 TSHR (0.46) POLBAPEX1HTTTDP1TSHR
SCHEMBL9554706 0.82 POLB (0.41) POLBAPEX1HTTTDP1TSHR
SCHEMBL9554912 0.82 TSHR (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL9555222 0.82 TSHR (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL9555175 0.82 TSHR (0.49) POLBAPEX1HTTTDP1TSHR
SCHEMBL13604258 0.81 PSIP1 (0.46) POLBAPEX1HTTTDP1MAPT
SCHEMBL24390169 0.81 HSD11B1 (0.46) POLBAPEX1HTTTDP1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed
US-20240241440-A1 POLYMER, PHOTORESIST COMPOSITIONS INCLUDING THE SAME, AND PATTERN FORMATION METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-07-18 US disclosed