SCHEMBL2661850

SCHEMBL2661850

CC(c1cccnc1)S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
CFTR P13569 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
SLC6A3 Q01959 1/20 0.46
GOPC Q9HD26 1/20 0.46
LMNA P02545 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.44
CYP2C9 P11712 1/20 0.43
NAMPT P43490 1/20 0.43
TBXAS1 P24557 2/20 0.42
KCNA5 P22460 2/20 0.41
KCNN4 O15554 1/20 0.41
POLB P06746 1/20 0.41
CYP19A1 P11511 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL27451595 0.85 CFTR (0.48) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL771190 0.82 KDM4E (0.46) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL30137058 0.81 CFTR (0.46) SMN1; SMN2CFTRSLC6A2SLC6A4SLC6A3
SCHEMBL27455320 0.80 NAPRT (0.43) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL27445792 0.79 NAPRT (0.50) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL5147826 0.79 SMN1; SMN2 (0.53) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL28179698 0.78 NAPRT (0.48) NAPRTSMN1; SMN2CFTRSLC6A2SLC6A4
SCHEMBL1645022 0.76 HPGD (0.43) SLC6A2SLC6A4SLC6A3L3MBTL1KDM4E
SCHEMBL248500 0.76 SRC (0.54) SMN1; SMN2LMNAKDM4EPOLBMAPT
SCHEMBL3398714 0.76 SRC (0.54) SMN1; SMN2LMNAKDM4EPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1874758-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2008-01-09 EP disclosed
WO-2006111516-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2006-10-26 WO disclosed