SCHEMBL8319622

SCHEMBL8319622

CC(C)(C)C(=O)N1COCC1=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.32
MEN1 O00255 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 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
SCHEMBL1027661 0.80
SCHEMBL12015352 0.71 ITGB1 (0.39) KMT2AMEN1SMN1; SMN2POLBKDM4E
SCHEMBL17898502 0.70 KMT2A (0.32) KMT2AMEN1
SCHEMBL13966498 0.68 POLB (0.34) POLB
SCHEMBL8319620 0.68 NAAA (0.46)
SCHEMBL12015351 0.68 LMNA (0.53) KMT2AMEN1SMN1; SMN2POLBKDM4E
SCHEMBL17898504 0.67 TP53 (0.35) KMT2AMEN1SMN1; SMN2
SCHEMBL12015371 0.67 SMN1; SMN2 (0.51) KMT2AMEN1SMN1; SMN2POLBKDM4E
SCHEMBL14748552 0.65 RIPK1 (0.36) KMT2AHPGD
SCHEMBL12015370 0.65 SMN1; SMN2 (0.54) KMT2AMEN1SMN1; SMN2POLBGAA

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-5972237-A USED AS COLD BLEACH ACTIVATORS OR OPTICAL BRIGHTENERS IN DETERGENTS, CLEANERS AND BLEACHES AND IN DISINFECTANTS BASF AKTIENGESELLSCHAFT (DE) 1999-10-26 US disclosed