SCHEMBL11539690

SCHEMBL11539690

Cc1cc(NC(=O)C2=C(O)c3ccsc3S(=O)(=O)C2)no1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
GAPDH P04406 1/20 0.49
MAPT P10636 4/20 0.48
MEN1 O00255 5/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 9/20 0.46
NPC1 O15118 8/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 2/20 0.45
USP2 O75604 1/20 0.45
KDR P35968 1/20 0.45
GAA P10253 2/20 0.44
TSHR P16473 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 3/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PPARG P37231 1/20 0.43

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
SCHEMBL11502646 0.78 USP2 (0.67) KMT2AGAPDHMAPTMEN1ALDH1A1
SCHEMBL11539898 0.75 KMT2A (0.46) KMT2AMAPTMEN1ALDH1A1HTT
SCHEMBL11850800 0.72 USP2 (0.60) KMT2AGAPDHMAPTMEN1RAB9A
SCHEMBL11470370 0.67 USP2 (0.67) KMT2AGAPDHMAPTMEN1ALDH1A1
SCHEMBL15427115 0.67 MAPT (1.00) KMT2AMAPTMEN1ALDH1A1HTT
SCHEMBL1520029 0.67 KMT2A (1.00) KMT2AGAPDHMAPTMEN1ALDH1A1
SCHEMBL10387798 0.65 RAB9A (0.51) KMT2AGAPDHMAPTMEN1ALDH1A1
SCHEMBL11652839 0.63 USP2 (0.62) KMT2AMEN1RAB9ANPC1LMNA
SCHEMBL30788250 0.63 RAB9A (1.00) KMT2AMAPTMEN1ALDH1A1RAB9A
SCHEMBL8909101 0.62 RAB9A (0.76) KMT2AMAPTMEN1ALDH1A1RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4127585-A Isoxazol amides of 4-hydroxy-6H-thieno[2,3-b]thiopyran-5-carboxylic acid-7,7-dioxide WARNER-LAMBERT COMPANY (US) 1978-11-28 US claimed
US-4154734-A Amides of 4-hydroxy-6H-thieno[2,3-b]thiopyran-5-carboxylic acid-7,7-dioxide WARNER-LAMBERT COMPANY (US) 1979-05-15 US disclosed
US-4134897-A Amides of 4-hydroxy-6H-thieno[2,3-b]thiopyran-5-carboxylic acid-7,7-dioxide and process for the preparation thereof WARNER-LAMBERT COMPANY (US) 1979-01-16 US disclosed
US-4127585-A Isoxazol amides of 4-hydroxy-6H-thieno[2,3-b]thiopyran-5-carboxylic acid-7,7-dioxide WARNER-LAMBERT COMPANY (US) 1978-11-28 US disclosed
US-4082757-A Amides of 4-hydroxy-6H-thieno[2,3-b]thiopyran-5-carboxylic acid-7,7-dioxide WARNER-LAMBERT COMPANY (US) 1978-04-04 US disclosed