SCHEMBL1497166

SCHEMBL1497166

Nc1cscc1NC(=O)c1ccc(C(CCN2CCOCC2)NC(=O)NCCc2ccccc2)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
MAPT P10636 5/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
KDM4E B2RXH2 4/20 0.41
LMNA P02545 4/20 0.41
KMT2A Q03164 3/20 0.41
TP53 P04637 3/20 0.41
HPGD P15428 3/20 0.41
CASP1 P29466 3/20 0.41
HTT P42858 3/20 0.41
CASP7 P55210 3/20 0.41
HSD17B10 Q99714 3/20 0.41
MEN1 O00255 2/20 0.41
USP2 O75604 2/20 0.41
ALOX15 P16050 2/20 0.41
GAA P10253 2/20 0.41
RECQL P46063 1/20 0.41
GLA P06280 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ATM Q13315 2/20 0.37

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
SCHEMBL1497209 0.96 ALDH1A1 (0.41) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL1482240 0.95 ALDH1A1 (0.40) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL1497050 0.93 ALDH1A1 (0.40) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL1497137 0.92 HDAC3 (0.39) ALDH1A1KDM4EKMT2AMEN1HIF1A
SCHEMBL2383602 0.89 MAPT (0.43) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL1496898 0.88 HDAC3 (0.38) ALDH1A1KDM4EKMT2AHSD17B10HIF1A
SCHEMBL1496925 0.87 CD274 (0.39) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL4234597 0.87 MAPT (0.43) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL1497026 0.86 POLB (0.45) ALDH1A1MAPTL3MBTL1KDM4ELMNA
SCHEMBL4229423 0.86 MAPT (0.42) ALDH1A1MAPTL3MBTL1KDM4ELMNA

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-2292611-B1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2012-07-25 EP disclosed
EP-2292611-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2011-03-09 EP disclosed