SCHEMBL29323739

SCHEMBL29323739

C=C(C)C(=O)OCC(C)S(=O)(=O)C(C)Cc1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
CA12 O43570 2/20 0.40
CA7 P43166 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
TRPA1 O75762 1/20 0.37
NOS2 P35228 5/20 0.37
NOS3 P29474 3/20 0.37
NOS1 P29475 3/20 0.37
ACACB O00763 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX2 P34913 1/20 0.33
PPARG P37231 1/20 0.33
HPGD P15428 1/20 0.33
GFER P55789 1/20 0.33

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
SCHEMBL29323725 0.80 TSHR (0.46) TSHRCA12CA7CA9CA14
SCHEMBL27775441 0.78 TRPA1 (0.50) CA12CA7CA9CA14TRPA1
SCHEMBL13836458 0.73 KDM4E (0.49) MEN1KMT2A
SCHEMBL21112020 0.70 THRB (0.47) TSHRHPGD
SCHEMBL28562708 0.69 TSHR (0.62) TSHR
SCHEMBL310753 0.69 TSHR (0.62) TSHR
SCHEMBL9163118 0.68 TSHR (0.51) TSHRMEN1KMT2A
SCHEMBL8939553 0.68 TSHR (0.60) TSHR
Ammonia Solution, Strong SCHEMBL27695564 0.68 TSHR (0.60) TSHR
SCHEMBL24507793 0.67 TSHR (0.50) TSHR

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