SCHEMBL14919781

SCHEMBL14919781

COc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c2cccnc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.70
GAA P10253 2/20 0.59
MEN1 O00255 1/20 0.58
GLA P06280 1/20 0.58
TSHR P16473 1/20 0.58
ALDH1A1 P00352 4/20 0.53
HPGD P15428 3/20 0.53
KDM4E B2RXH2 2/20 0.53
HSD17B10 Q99714 2/20 0.53
LMNA P02545 3/20 0.46
HIF1A Q16665 1/20 0.46
EPAS1 Q99814 1/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 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
SCHEMBL14932874 0.89 KMT2A (0.55) KMT2AGAAMEN1GLATSHR
SCHEMBL14919673 0.87 KMT2A (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL8327919 0.85 KMT2A (0.65) KMT2AGAAMEN1GLATSHR
SCHEMBL8327880 0.83 KMT2A (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL14919337 0.82 KMT2A (1.00) KMT2AGAAMEN1GLATSHR
SCHEMBL7399750 0.78 ALDH1A1 (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL14919787 0.75 KMT2A (0.86) KMT2AGAAMEN1GLATSHR
SCHEMBL14919675 0.74 KMT2A (0.56) KMT2AGAAMEN1GLATSHR
SCHEMBL14919761 0.74 KMT2A (1.00) KMT2AGAAMEN1GLATSHR
SCHEMBL14919619 0.74 GAA (0.69) KMT2AGAAMEN1GLATSHR

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
WO-2013066469-A2 KINASE INHIBITORS CAPABLE OF INCREASING THE SENSITIVITY OF BACTERIAL PATHOGENS TO B-LACTAM ANTIBIOTICS SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2013-05-10 WO claimed
WO-2013066469-A2 KINASE INHIBITORS CAPABLE OF INCREASING THE SENSITIVITY OF BACTERIAL PATHOGENS TO B-LACTAM ANTIBIOTICS SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2013-05-10 WO disclosed