SCHEMBL8632208

SCHEMBL8632208

COc1ccc(-c2c[nH]nc2NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.51
PGR P06401 1/20 0.48
POLB P06746 1/20 0.48
CKS1B P61024 1/20 0.47
SKP2 Q13309 1/20 0.47
KEAP1 Q14145 2/20 0.47
SQSTM1 Q13501 1/20 0.47
NFE2L2 Q16236 1/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
PRKAB2 O43741 1/20 0.46
PRKAG1 P54619 1/20 0.46
PRKAA2 P54646 1/20 0.46
PRKAA1 Q13131 1/20 0.46
PRKAG3 Q9UGI9 1/20 0.46
PRKAG2 Q9UGJ0 1/20 0.46
PRKAB1 Q9Y478 1/20 0.46
TUBB4A P04350 1/20 0.46

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
SCHEMBL8632286 0.88 KIT (0.45) PGRKEAP1MAPTLMNAKMT2A
SCHEMBL8632837 0.87 LMNA (0.51) POLBCKS1BSKP2KEAP1NFE2L2
SCHEMBL8631402 0.86 MAPT (0.57) KEAP1SQSTM1NFE2L2MAPTLMNA
SCHEMBL8632624 0.84 SMN1; SMN2 (0.48) MAPTSMN1; SMN2LMNAPRKAA1KMT2A
SCHEMBL8631178 0.84 STAT3 (0.47) STAT3POLBKEAP1NFE2L2MAPT
SCHEMBL8627973 0.84 KDM1A (0.51) PGRPOLBMAPTLMNAKMT2A
SCHEMBL8634763 0.84 NAT1 (0.45) KEAP1MAPTSMN1; SMN2KMT2AALDH1A1
SCHEMBL8632960 0.84 KEAP1 (0.51) POLBKEAP1MAPTSMN1; SMN2LMNA
SCHEMBL8631560 0.84 SLC40A1 (0.44) MAPTTP53FFAR4
SCHEMBL8628203 0.84 ALDH1A1 (0.46) POLBMAPTSMN1; SMN2LMNAKMT2A

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