SCHEMBL14920079

SCHEMBL14920079

COc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)c2cccnc12

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.76
KMT2A Q03164 4/20 0.64
MEN1 O00255 3/20 0.64
SLC40A1 Q9NP59 6/20 0.59
ALDH1A1 P00352 3/20 0.58
KDM4E B2RXH2 2/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 1/20 0.54
FABP4 P15090 1/20 0.54
MAPT P10636 1/20 0.52
NPC1 O15118 1/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL14920008 0.88 POLB (0.64) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919509 0.83 KMT2A (0.65) POLBKMT2AMEN1ALDH1A1KDM4E
SCHEMBL14919481 0.82 POLB (0.68) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919803 0.81 POLB (0.67) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919833 0.79 TSHR (0.60) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919801 0.79 POLB (0.59) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919795 0.78 POLB (0.58) POLBKMT2AMEN1SLC40A1ALDH1A1
SCHEMBL14919916 0.77 ALDH1A1 (0.61) POLBKMT2AMEN1ALDH1A1KDM4E
SCHEMBL14919775 0.77 ALDH1A1 (0.82) POLBKMT2AMEN1ALDH1A1KDM4E
SCHEMBL22095985 0.77 ALDH1A1 (0.73) KMT2AMEN1ALDH1A1HSD17B10FABP4

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