SCHEMBL1647757

SCHEMBL1647757

CN1CCN(S(=O)(=O)c2ccc(O)c(C(=O)O)c2)CC1

nearest known ligand 0.88

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.88
HSD17B10 Q99714 3/20 0.59
HPGD P15428 2/20 0.59
GAA P10253 1/20 0.59
MAPT P10636 1/20 0.59
CYP2C19 P33261 1/20 0.59
KMT2A Q03164 1/20 0.57
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.55
TSHR P16473 2/20 0.55
CYP3A4 P08684 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL1546612 0.87 POLB (0.76) POLBHSD17B10HPGDMAPTKMT2A
SCHEMBL396705 0.86 KMT2A (0.77) POLBHSD17B10HPGDGAAMAPT
SCHEMBL1000486 0.85 POLB (0.74) POLBHSD17B10HPGDMAPTKMT2A
SCHEMBL1649376 0.85 POLB (0.66) POLBHSD17B10HPGDKMT2AKDM4E
SCHEMBL6207027 0.84 CYP3A4 (0.75) POLBHSD17B10HPGDGAAMAPT
SCHEMBL28653785 0.84 HSD17B10 (0.77) POLBHSD17B10HPGDGAAMAPT
SCHEMBL395198 0.84 KMT2A (0.75) POLBHSD17B10HPGDGAAMAPT
SCHEMBL28655730 0.84 POLB (0.65) POLBHSD17B10HPGDGAAMAPT
SCHEMBL1645604 0.82 APEX1 (0.72) POLBHSD17B10HPGDGAAMAPT
Sulfosalicylic SCHEMBL26603634 0.81 KDM4E (0.66) POLBHSD17B10HPGDGAAKMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2483254-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2012-08-08 EP disclosed
WO-2011038572-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-04-07 WO disclosed
EP-2024369-A2 NOVEL PROCESS FOR THE PREPARATION OF SILDENAFIL CITRATE Matrix Laboratories Ltd (IN) 2009-02-18 EP disclosed
WO-2007141805-A2 NOVEL PROCESS FOR THE PREPARATION OF SILDENAFIL CITRATE MATRIX LABORATORIES LIMITED (IN) 2007-12-13 WO disclosed
WO-2007141805-A2 NOVEL PROCESS FOR THE PREPARATION OF SILDENAFIL CITRATE MATRIX LABORATORIES LIMITED (IN) 2007-12-13 WO disclosed