SCHEMBL8775880

SCHEMBL8775880

CCOC(=O)CC(c1ccccc1)c1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TBXAS1 P24557 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
PDE4D Q08499 1/20 0.50
KCNA5 P22460 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
CFTR P13569 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
GOPC Q9HD26 1/20 0.45

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
SCHEMBL7178642 0.87 ALDH1A1 (0.55) LMNASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL5929541 0.85 LMNA (0.48) LMNATBXAS1SMN1; SMN2PDE4DKCNA5
SCHEMBL2370448 0.85 L3MBTL1 (0.47) LMNATBXAS1SMN1; SMN2KCNA5MEN1
SCHEMBL5160706 0.85 LMNA (0.48) LMNATBXAS1SMN1; SMN2PDE4DKCNA5
SCHEMBL27396676 0.85 ITGB3 (0.45) TBXAS1KCNA5MEN1KMT2A
SCHEMBL1294805 0.84 LMNA (0.43) LMNATBXAS1SMN1; SMN2PDE4DKCNA5
SCHEMBL1294809 0.84 LMNA (0.43) LMNATBXAS1SMN1; SMN2PDE4DKCNA5
SCHEMBL16462158 0.84 ALDH1A1 (0.45) LMNAMEN1KMT2AGAAALDH1A1
SCHEMBL7130315 0.84 LMNA (0.43) LMNATBXAS1SMN1; SMN2PDE4DKCNA5
SCHEMBL27224522 0.84 MEN1 (0.44) LMNATBXAS1SMN1; SMN2PDE4DKCNA5

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
EP-0807626-A1 N-HYDROXYUREA DERIVATIVES Nikken Chemicals Company, Limited (JP) 1997-11-19 EP disclosed