SCHEMBL4593524

SCHEMBL4593524

CNS(=O)(=O)CCCn1cncc1-c1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 5/20 0.42
MAPK12 P53778 5/20 0.42
MAPK11 Q15759 5/20 0.42
MAPK14 Q16539 5/20 0.42
CYP11B1 P15538 7/20 0.40
CYP11B2 P19099 7/20 0.40
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
IDO1 P14902 1/20 0.35
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32

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
SCHEMBL7076732 0.71 CYP11B1 (0.43) MAPK13MAPK12MAPK11MAPK14CYP11B1
SCHEMBL27550009 0.70 CYP11B1 (0.56) CYP11B1CYP11B2IDO1
SCHEMBL7748830 0.67 NFATC1 (0.58) MAPK13MAPK12MAPK11MAPK14
SCHEMBL1948648 0.66 CYP11B1 (0.48) CYP11B1CYP11B2LMNAHPGDIDO1
SCHEMBL593796 0.65 CYP11B1 (0.58) CYP11B1CYP11B2HPGDIDO1
SCHEMBL27984310 0.64 CYP11B1 (0.51) CYP11B1CYP11B2LMNAIDO1
SCHEMBL6751976 0.64 KMT2A (0.53) LMNAHPGD
SCHEMBL1950305 0.63 CYP11B1 (0.48) CYP11B1CYP11B2IDO1
SCHEMBL10983627 0.63 IDO1 (0.44) MAPK14CYP11B1CYP11B2LMNAIDO1
SCHEMBL15653534 0.63 CYP11B1 (0.54) CYP11B1CYP11B2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583535-A4 METHODS FOR TREATING DIABETES SCIOS INC (US) 2008-03-19 EP disclosed
EP-1583535-A2 METHODS FOR TREATING DIABETES SCIOS INC. (US) 2005-10-12 EP disclosed
WO-2004053107-A2 METHODS FOR TREATING DIABETES SCIOS INC. (US) 2004-06-24 WO disclosed