SCHEMBL11684109

SCHEMBL11684109

COc1ccc(CN2C(=O)CCC2=S)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
ALDH1A1 P00352 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
BLM P54132 1/20 0.62
GSK3A P49840 3/20 0.61
GSK3B P49841 3/20 0.61
CMA1 P23946 1/20 0.60
MAPT P10636 1/20 0.55
GAA P10253 3/20 0.51
CASP3 P42574 2/20 0.50
APAF1 O14727 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HTT P42858 1/20 0.49
POLB P06746 1/20 0.47

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
SCHEMBL41389 0.89 CMA1 (0.70) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL40778 0.82 CMA1 (0.66) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL31114554 0.78 POLB (0.60) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL23120576 0.77 MEN1 (0.61) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL25339653 0.77 GSK3A (0.59) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL30100692 0.77 POLB (0.71) MEN1KMT2AL3MBTL1GSK3AGSK3B
SCHEMBL30100689 0.77 POLB (0.71) MEN1KMT2AL3MBTL1GSK3AGSK3B
SCHEMBL29173745 0.77 CMA1 (0.54) MEN1KMT2AALDH1A1L3MBTL1BLM
SCHEMBL4328336 0.77 POLB (0.71) MEN1KMT2AL3MBTL1GSK3AGSK3B
Hydrochloric Acid SCHEMBL30616170 0.76 MEN1 (0.59) MEN1KMT2AALDH1A1L3MBTL1BLM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4001025-A SILVER SULFIDE, DIGESTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1977-01-04 US claimed
US-4001025-A SILVER SULFIDE, DIGESTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1977-01-04 US disclosed