SCHEMBL14919761

SCHEMBL14919761

CCCCN(CCCC)S(=O)(=O)c1ccc(OC)c2ncccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 1.00
MEN1 O00255 3/20 1.00
TSHR P16473 2/20 1.00
GLA P06280 1/20 1.00
GAA P10253 2/20 0.69
ALDH1A1 P00352 4/20 0.65
KDM4E B2RXH2 2/20 0.65
HPGD P15428 2/20 0.65
HSD17B10 Q99714 2/20 0.65
POLB P06746 2/20 0.47
LMNA P02545 3/20 0.46
COMT P21964 1/20 0.46
MAPT P10636 2/20 0.45
RXFP1 Q9HBX9 1/20 0.44
RECQL P46063 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PAX8 Q06710 1/20 0.43
KLF5 Q13887 1/20 0.43
HTR7 P34969 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
SCHEMBL14919787 0.93 KMT2A (0.86) KMT2AMEN1TSHRGLAGAA
SCHEMBL8327880 0.83 KMT2A (0.71) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919619 0.81 GAA (0.69) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919711 0.79 ALDH1A1 (1.00) KMT2AMEN1TSHRGLAGAA
SCHEMBL1333403 0.78 COMT (0.63) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919793 0.77 ALDH1A1 (0.91) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919673 0.76 KMT2A (0.71) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919337 0.76 KMT2A (1.00) KMT2AMEN1TSHRGLAGAA
SCHEMBL14919706 0.75 FTO (0.63) KMT2AMEN1TSHRGLAGAA
SCHEMBL1332026 0.75 KMT2A (0.62) KMT2AMEN1TSHRGLAGAA

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