SCHEMBL11230486

SCHEMBL11230486

CC(CN)NCC(=O)OC(C)C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
TSHR P16473 2/20 0.35
NLRP3 Q96P20 1/20 0.34
MAPT P10636 2/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL11379925 0.83 GAA (0.41) LMNATSHRALDH1A1
SCHEMBL11239489 0.81 LMNA (0.43) LMNATSHRMAPTALDH1A1
SCHEMBL423404 0.79 LMNA (0.42) LMNAPPARGNCOA2NCOA1NPSR1
SCHEMBL2039271 0.78 GAA (0.46) TSHRMAPTALDH1A1
Hydrochloric Acid SCHEMBL21629430 0.77 LMNA (0.41) LMNAPPARGNCOA2NCOA1NPSR1
SCHEMBL11232742 0.76 LMNA (0.37) LMNAPPARGNCOA2NCOA1NPSR1
SCHEMBL11232403 0.76 KDM4E (0.33) MAPTALDH1A1
SCHEMBL18025607 0.74
SCHEMBL10142215 0.73 LMNA (0.42) LMNAPPARGNCOA2NCOA1NPSR1
SCHEMBL5933090 0.73 LMNA (0.45) LMNAPPARGNCOA2NCOA1NPSR1

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-4315846-A FUNGICIDES TOKYO ORGANIC CHEMICAL INDUSTRIES, LTD. (JP) 1982-02-16 US disclosed