SCHEMBL11872002

SCHEMBL11872002

CCCN1C(=O)CC(=O)N(C)C1=S

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.33
ALDH1A1 P00352 4/20 0.33
GAA P10253 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALOX12 P18054 1/20 0.33
ATM Q13315 2/20 0.33
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 2/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
CYP19A1 P11511 1/20 0.32
USP2 O75604 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
THRB P10828 1/20 0.30
TOP2A P11388 1/20 0.30

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
SCHEMBL6162730 0.90 MAPT (0.35) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL11868886 0.89 KDM4E (0.43) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL6374912 0.86 F2 (0.37) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL11470645 0.79 MAPT (0.40) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL472573 0.78 GSK3A (0.42) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL145408 0.78 KDM4E (0.46) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL11867011 0.77 GAA (0.41) ALDH1A1GAAGSK3AGSK3B
SCHEMBL14211413 0.77 ALDH1A1 (0.49) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL678530 0.76 MAPT (0.48) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL8652814 0.76 MGLL (0.47) MAPTALDH1A1GAAMEN1KMT2A

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
US-3961061-A INSECTICIDES, FUNGICIDES, BACTERICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-06-01 US disclosed