SCHEMBL14919803

SCHEMBL14919803

COc1ccc(OC)c(NS(=O)(=O)c2ccc(OC)c3ncccc23)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.67
MAPT P10636 2/20 0.62
ALDH1A1 P00352 5/20 0.57
HPGD P15428 2/20 0.57
KDM4E B2RXH2 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TSHR P16473 2/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 4/20 0.56
NPSR1 Q6W5P4 2/20 0.56
SLC40A1 Q9NP59 2/20 0.55
LMNA P02545 2/20 0.55
AGTR1 P30556 1/20 0.52
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL14919481 0.87 POLB (0.68) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14919972 0.86 ALDH1A1 (0.71) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14919833 0.82 TSHR (0.60) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14920008 0.81 POLB (0.64) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14919801 0.81 POLB (0.59) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14920079 0.81 POLB (0.76) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14919795 0.81 POLB (0.58) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL14919916 0.80 ALDH1A1 (0.61) POLBMAPTALDH1A1HPGDKDM4E
SCHEMBL4470146 0.78 MEN1 (0.71) POLBMAPTALDH1A1HPGDTSHR
SCHEMBL14919509 0.77 KMT2A (0.65) POLBMAPTALDH1A1HPGDKDM4E

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