SCHEMBL6962972

SCHEMBL6962972

[CH2]OC(=O)c1snnc1C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.56
THRB P10828 1/20 0.56
POLB P06746 2/20 0.50
LMNA P02545 3/20 0.44
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL2211256 0.78 MAPT (0.54) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL4950288 0.77 MAPT (0.55) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL20267448 0.74 MAPT (0.50) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL452517 0.74
SCHEMBL7662839 0.73 MAPT (0.49) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL4779258 0.72
Hydrochloric Acid SCHEMBL6602988 0.72 LMNA (0.51) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL13545146 0.69 MAPT (0.45) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL13543211 0.69 ALDH1A1 (0.45) MAPTTHRBPOLBLMNAALDH1A1
SCHEMBL12292649 0.69 LMNA (0.57) MAPTPOLBLMNAALDH1A1MEN1

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed