SCHEMBL16488024

SCHEMBL16488024

O=C1CCc2cc(S(=O)(=O)NC(C(=O)Nc3ccc(F)cc3F)c3ccccc3)ccc2N1

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.71
OGT O15294 11/20 0.71
TP53 P04637 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
MAPT P10636 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
ALDH1A1 P00352 1/20 0.64
TSHR P16473 1/20 0.64
HSD17B10 Q99714 1/20 0.64
GAA P10253 1/20 0.58

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
SCHEMBL16487630 0.92 POLB (0.77) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16487588 0.89 MAPT (0.81) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16488025 0.88 OGT (0.73) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16487947 0.85 TP53 (0.85) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16488028 0.85 OGT (0.82) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16487603 0.84 MAPT (0.76) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16487972 0.83 OGT (0.75) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16488013 0.83 POLB (1.00) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL4547301 0.83 OGT (1.00) POLBOGTTP53SMN1; SMN2MAPT
SCHEMBL16487942 0.82 SMN1; SMN2 (1.00) POLBOGTTP53SMN1; SMN2MAPT

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
US-8957075-B2 O-GlcNAc transferase inhibitors and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-02-17 US disclosed