SCHEMBL29323726

SCHEMBL29323726

C=C(C)C(=O)OCCS(=O)(=O)c1ccc(I)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HTT P42858 4/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
CA2 P00918 1/20 0.40
THRB P10828 1/20 0.39
POLB P06746 3/20 0.39
APEX1 P27695 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 3/20 0.38
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 1/20 0.37
F2 P00734 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL8896484 0.87 ALDH1A1 (0.50) ALDH1A1KMT2ALMNAGAACA2
SCHEMBL9555297 0.87 KMT2A (0.48) ALDH1A1HTTKMT2ALMNAMEN1
SCHEMBL1130280 0.85 MAPT (0.47) HTTLMNACA2THRBPOLB
SCHEMBL29323722 0.82 MMP1 (0.50) ALDH1A1HTTKMT2ALMNAMEN1
SCHEMBL15502182 0.79 THRB (0.46) ALDH1A1KMT2ALMNAGAACA2
SCHEMBL15502162 0.79 THRB (0.46) ALDH1A1KMT2ALMNAGAACA2
SCHEMBL9554954 0.79 THRB (0.46) ALDH1A1HTTKMT2ALMNAMEN1
SCHEMBL29323724 0.79 HTT (0.33) ALDH1A1HTTKMT2ALMNAMEN1
SCHEMBL9555062 0.78 HTT (0.47) ALDH1A1HTTKMT2ALMNAMEN1
SCHEMBL9555489 0.77 TSHR (0.46) ALDH1A1HTTKMT2ALMNAMEN1

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