SCHEMBL28030353

SCHEMBL28030353

NC(=O)CC(C(N)=O)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
SARM1 Q6SZW1 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
SIRT4 Q9Y6E7 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
TBXAS1 P24557 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CFTR P13569 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
GOPC Q9HD26 1/20 0.42
RECQL P46063 1/20 0.41
HTT P42858 2/20 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
SCHEMBL27655396 0.86 LMNA (0.45) LMNAF7F3SARM1SIRT2
SCHEMBL27956701 0.85 F7 (0.46) LMNAF7F3SARM1SIRT2
SCHEMBL2436131 0.83 SMN1; SMN2 (0.49) LMNAF7F3SARM1SIRT2
SCHEMBL29931638 0.83 SMN1; SMN2 (0.49) LMNAF7F3SARM1SIRT2
SCHEMBL17591689 0.83 LMNA (0.54) LMNAF7F3SARM1SIRT2
SCHEMBL28085892 0.83 TBXAS1 (0.49) LMNAF7F3SARM1SIRT2
SCHEMBL15591082 0.81 LMNA (0.46) LMNAF7F3SARM1SIRT2
SCHEMBL27956700 0.81 L3MBTL1 (0.49) LMNAF7F3SARM1SIRT2
SCHEMBL3641593 0.81 CTSL (0.47) LMNAF7F3SARM1SIRT2
SCHEMBL11004067 0.81 SMN1; SMN2 (0.47) LMNAF7F3SARM1SIRT2

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
CN-104860970-B A kind of zinc coordination polymer and the preparation method of Congo red complex thereof and purposes 苏州大学 2016-10-12 CN claimed
CN-104860970-A Preparation method and application of zinc coordination polymer and Congo red complex thereof UNIV SOOCHOW 2015-08-26 CN claimed
CN-104860970-B A kind of zinc coordination polymer and the preparation method of Congo red complex thereof and purposes 苏州大学 2016-10-12 CN disclosed
CN-103936796-B A kind of based on flexible double Pyridine bisamide parts and the cobalt complex of benzene dicarboxylic acid and synthetic method thereof with application 渤海大学 2016-08-17 CN disclosed
CN-104860970-A Preparation method and application of zinc coordination polymer and Congo red complex thereof UNIV SOOCHOW 2015-08-26 CN disclosed