SCHEMBL29323843

SCHEMBL29323843

C=Cc1ccc(C(=O)OC(CS(=O)(=O)c2ccc(C(F)(F)F)cc2)CS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.43
AKR1C3 P42330 1/20 0.40
MMP9 P14780 2/20 0.40
MMP2 P08253 1/20 0.40
MMP1 P03956 1/20 0.39
CHEK1 O14757 1/20 0.38
AURKA O14965 1/20 0.38
NTRK1 P04629 1/20 0.38
MET P08581 1/20 0.38
PIM1 P11309 1/20 0.38
FGFR1 P11362 1/20 0.38
PRKACA P17612 1/20 0.38
GRK5 P34947 1/20 0.38
MAP2K2 P36507 1/20 0.38
FLT3 P36888 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
CDK8 P49336 1/20 0.38
GSK3B P49841 1/20 0.38
CDK7 P50613 1/20 0.38

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
SCHEMBL29323853 0.87 TDP1 (0.39) HSD11B1AKR1C3CA1CA2CA9
SCHEMBL29323852 0.85 CA2 (0.41) CA1CA2CA9CA12TDP1
SCHEMBL29323813 0.84 POLB (0.40) HSD11B1CYP2C19CA9CA12TDP1
SCHEMBL29323835 0.74 TAS1R3 (0.40) CA1CA2CA9CA12TDP1
SCHEMBL16850005 0.72 TDP1 (0.37) TDP1
SCHEMBL3005028 0.72 PRSS1 (0.58) CYP1A1CYP1B1MAOBTDP1CYP11B1
SCHEMBL2886501 0.69 TDP1 (0.39) CA1CA2CA9CA12TDP1
SCHEMBL12122945 0.68 TAS1R3 (0.38) CYP1A1CYP1B1MAOBCA1CA2
SCHEMBL23197630 0.68 HSD11B1 (0.59) HSD11B1MMP9MMP2MMP1CHEK1
SCHEMBL2742183 0.68 TDP1 (0.38) CA1CA2CA9CA12TDP1

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