SCHEMBL14919337

SCHEMBL14919337

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 1.00
GAA P10253 2/20 0.62
MEN1 O00255 1/20 0.61
GLA P06280 1/20 0.61
TSHR P16473 1/20 0.61
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 2/20 0.55
HPGD P15428 2/20 0.55
HSD17B10 Q99714 2/20 0.55
POLB P06746 3/20 0.46
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 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
SCHEMBL14919673 0.83 KMT2A (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL14919781 0.82 KMT2A (0.70) KMT2AGAAMEN1GLATSHR
SCHEMBL8327919 0.79 KMT2A (0.65) KMT2AGAAMEN1GLATSHR
SCHEMBL14919787 0.78 KMT2A (0.86) KMT2AGAAMEN1GLATSHR
SCHEMBL1333403 0.77 COMT (0.63) KMT2AGAAMEN1GLATSHR
SCHEMBL14919706 0.77 FTO (0.63) KMT2AGAAMEN1GLATSHR
SCHEMBL1332026 0.77 KMT2A (0.62) KMT2AGAAMEN1GLATSHR
SCHEMBL8327880 0.76 KMT2A (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL7399750 0.76 ALDH1A1 (0.71) KMT2AGAAMEN1GLATSHR
SCHEMBL14919761 0.76 KMT2A (1.00) 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 1 patent. 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 disclosed