SCHEMBL27629907

SCHEMBL27629907

CCOC(=O)Cc1csc(NS(=O)(=O)c2ccccc2Cl)n1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.78
MEN1 O00255 6/20 0.78
POLB P06746 2/20 0.78
ALDH1A1 P00352 3/20 0.73
CYP2C9 P11712 1/20 0.73
CYP2C19 P33261 1/20 0.73
HSD17B1 P14061 1/20 0.64
HSD11B1 P28845 1/20 0.64
HSD17B2 P37059 1/20 0.64
PKM P14618 2/20 0.63
MAPT P10636 3/20 0.60
RAB9A P51151 2/20 0.60
LMNA P02545 2/20 0.60
KDM4E B2RXH2 1/20 0.60
NPC1 O15118 1/20 0.60
HTT P42858 1/20 0.59
HSD17B10 Q99714 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CDK5 Q00535 1/20 0.57
CDK5R1 Q15078 1/20 0.57

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
SCHEMBL3614035 0.92 HSD11B1 (0.77) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27629852 0.88 ALDH1A1 (0.74) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27629846 0.88 KMT2A (0.67) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27630226 0.87 ALDH1A1 (0.73) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL3618130 0.86 ALDH1A1 (0.72) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27629900 0.86 KMT2A (0.76) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27629873 0.86 KMT2A (0.79) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27630054 0.86 KMT2A (0.72) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL28756762 0.85 ALDH1A1 (0.70) KMT2AMEN1POLBALDH1A1CYP2C9
SCHEMBL27630189 0.85 ALDH1A1 (0.70) KMT2AMEN1POLBALDH1A1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1812784-A New use i BIOVITRUM AB (SE) 2006-08-02 CN claimed
CN-1812784-A New use i BIOVITRUM AB (SE) 2006-08-02 CN disclosed