SCHEMBL8633701

SCHEMBL8633701

COc1ccc(-c2c(NS(=O)(=O)c3ccccc3)n[nH]c2C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 5/20 0.45
GPR55 Q9Y2T6 2/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
STAT3 P40763 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
BLM P54132 1/20 0.43
PGR P06401 1/20 0.43
POLB P06746 1/20 0.43
KCNQ3 O43525 1/20 0.42
KCNQ2 O43526 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CRHBP P24387 1/20 0.42

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
SCHEMBL8631696 0.89 SLC40A1 (0.42) MAPTL3MBTL1TP53
SCHEMBL8629976 0.88 L3MBTL1 (0.51) KMT2AMAPTGPR55CNR1CNR2
SCHEMBL8627678 0.88 MAPT (0.51) KMT2AGAAMAPTMEN1ALDH1A1
SCHEMBL8629853 0.87 MEN1 (0.45) KMT2AGAAMAPTL3MBTL1MEN1
SCHEMBL8630471 0.86 SMN1; SMN2 (0.43) KMT2AGAAMAPTMEN1SMN1; SMN2
SCHEMBL8631355 0.86 L3MBTL1 (0.44) KMT2AMAPTL3MBTL1MEN1POLB
SCHEMBL8633591 0.85 L3MBTL1 (0.43) KMT2AMAPTGPR55L3MBTL1MEN1
SCHEMBL8635392 0.85 L3MBTL1 (0.49) KMT2AMAPTL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL8632682 0.85 KDM1A (0.46) KMT2AMAPTL3MBTL1MEN1ALDH1A1
SCHEMBL8627990 0.84 HPGD (0.41) KMT2AGAAMAPTL3MBTL1MEN1

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-5756530-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS G. D. SEARLE & CO. (US) 1998-05-26 US disclosed