SCHEMBL28536149

SCHEMBL28536149

O=S(O)C(Nc1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.40
▸ LMNA P02545 2/20 0.39
▸ RECQL P46063 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ HSD17B10 Q99714 2/20 0.37
▸ SLC6A3 Q01959 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ RCE1 Q9Y256 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL30565311 0.69 SLC6A3 (0.50) LMNASLC6A3PDE4DCYP2D6SRC
SCHEMBL11845106 0.67 SRC (0.42) TDP1LMNASLC6A3PDE4DCYP2D6
SCHEMBL1001132 0.67 LMNA (0.46) LMNASLC6A3TSHRCYP2D6SRC
SCHEMBL8193205 0.67 TDP1 (0.48) CA12CA9POLBTDP1LMNA
SCHEMBL2483521 0.67 FPR2 (0.49) CA12CA9POLBTDP1LMNA
SCHEMBL146704 0.67 FPR2 (0.49) CA12CA9POLBTDP1LMNA
SCHEMBL2483519 0.67 FPR2 (0.49) CA12CA9POLBTDP1LMNA
SCHEMBL2361907 0.66 CFTR (0.63) CA12CA9TDP1LMNARECQL
SCHEMBL19367686 0.66 TDP1 (0.52) CA12CA9POLBTDP1LMNA
SCHEMBL9720401 0.66 TDP1 (0.52) CA12CA9POLBTDP1LMNA

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
CN-112513016-A Sulfur-containing polymerizable monomer and use thereof 尚美德齿科材料有限公司 2021-03-16 — — CN disclosed
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