SCHEMBL7658908

SCHEMBL7658908

COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCSC(=O)C1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.53
CPT1A P50416 5/20 0.52
PKM P14618 1/20 0.51
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
CPT1B Q92523 4/20 0.46
CPT2 P23786 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 1/20 0.44
GAA P10253 1/20 0.44
ERAP2 Q6P179 1/20 0.44
ERAP1 Q9NZ08 1/20 0.44
POLB P06746 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
SCHEMBL7662928 0.80 SMN1; SMN2 (0.70) KMT2AMEN1PKMRAB9ANPC1
SCHEMBL7661631 0.78 RAB9A (0.73) KMT2AMEN1PKMRAB9ANPC1
SCHEMBL1001171 0.77 RAB9A (0.72) KMT2AMEN1RAB9ANPC1CASP3
SCHEMBL7661191 0.77 RAB9A (0.72) KMT2AMEN1RAB9ANPC1CASP3
SCHEMBL751297 0.77 CPT1A (0.82) KMT2ACPT1ACPT1BCPT2
SCHEMBL7656561 0.76 KMT2A (0.65) KMT2AMEN1PKMRAB9ANPC1
SCHEMBL3963711 0.75 POLB (0.71) KMT2AMEN1SMN1; SMN2L3MBTL1GAA
SCHEMBL7657082 0.74 KMT2A (0.63) KMT2AMEN1PKMRAB9ANPC1
SCHEMBL7662995 0.74 KMT2A (0.60) KMT2AMEN1PKMRAB9ANPC1
SCHEMBL7665175 0.73 KMT2A (0.65) KMT2AMEN1PKMRAB9ANPC1

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-6355633-B1 CONTRACEPTIVES AMERICAN HOME PRODUCTS CORPORATION 2002-03-12 US disclosed