SCHEMBL7314686

SCHEMBL7314686

COc1ccc(S(=O)(=O)Nc2cccc(C)c2C(=O)OCc2ccccc2)c(Cc2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.48
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KEAP1 Q14145 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
SLC16A3 O15427 1/20 0.42
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7323413 0.90 TP53 (0.45) TP53MAPTALDH1A1L3MBTL1MEN1
SCHEMBL7325273 0.89 MEN1 (0.49) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL7323166 0.86 ALDH1A1 (0.44) TP53ALDH1A1L3MBTL1LMNAHPGD
SCHEMBL7317479 0.84 TP53 (0.47) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL7317380 0.84 TP53 (0.47) TP53ALDH1A1L3MBTL1LMNAHPGD
SCHEMBL7323299 0.81 MEN1 (0.45) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7322403 0.80 MTNR1A (0.46) ALDH1A1MEN1KMT2ANPC1SLC16A3
SCHEMBL7316263 0.80 MEN1 (0.67) TP53ALDH1A1L3MBTL1LMNAHPGD
SCHEMBL7313454 0.78 ACLY (0.51) ALDH1A1HPGDMEN1KMT2ANPC1
SCHEMBL7321851 0.77 METAP2 (0.58) MAPTALDH1A1LMNAHPGDSMN1; SMN2

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-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed