SCHEMBL14919675

SCHEMBL14919675

COc1ccc(S(=O)(=O)CNCc2ccccc2)c2cccnc12

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 7/20 0.54
HPGD P15428 5/20 0.54
KDM4E B2RXH2 5/20 0.54
HSD17B10 Q99714 2/20 0.54
GAA P10253 2/20 0.52
LMNA P02545 3/20 0.52
MEN1 O00255 1/20 0.51
GLA P06280 1/20 0.51
TSHR P16473 1/20 0.51
POLB P06746 3/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
COMT P21964 1/20 0.44

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
SCHEMBL7399750 0.84 ALDH1A1 (0.71) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL14919338 0.84 KMT2A (0.58) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL14919673 0.77 KMT2A (0.71) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL8327919 0.75 KMT2A (0.65) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL14919781 0.74 KMT2A (0.70) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL14919775 0.74 ALDH1A1 (0.82) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL4731802 0.74 ALDH1A1 (0.58) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL9397296 0.74 ALDH1A1 (0.69) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL14919706 0.73 FTO (0.63) KMT2AALDH1A1HPGDKDM4EHSD17B10
SCHEMBL1332026 0.73 KMT2A (0.62) KMT2AALDH1A1HPGDKDM4EHSD17B10

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