SCHEMBL15427209

SCHEMBL15427209

O=S(=O)(c1ccc(OCF)cc1)N1CCC2(CC1)OCCN2S(=O)(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.52
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 1/20 0.45
PRCP P42785 2/20 0.44
HTR1A P08908 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
EPHX2 P34913 1/20 0.40

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
SCHEMBL12655999 0.93 L3MBTL1 (0.58) L3MBTL1MEN1KMT2AALDH1A1PRCP
SCHEMBL12621946 0.88 L3MBTL1 (0.61) L3MBTL1MEN1KMT2AALDH1A1EPHX2
SCHEMBL12623940 0.81 L3MBTL1 (0.50) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL12621942 0.80 L3MBTL1 (0.49) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL15423912 0.80 L3MBTL1 (0.45) L3MBTL1MEN1KMT2AALDH1A1HTR1A
SCHEMBL15693684 0.79 L3MBTL1 (0.46) L3MBTL1ALDH1A1
SCHEMBL12621923 0.78 L3MBTL1 (0.78) L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL12655986 0.78 L3MBTL1 (0.54) L3MBTL1MEN1KMT2AALDH1A1EPHX2
SCHEMBL12622049 0.76 L3MBTL1 (0.58) L3MBTL1ALDH1A1
SCHEMBL12621863 0.76 LMNA (0.62) L3MBTL1MEN1KMT2AALDH1A1

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-9500640-B2 Alzheimer's disease assay in a living patient PAIN THERAPEUTICS, INC. (US) 2016-11-22 US disclosed
US-20140017699-A1 ALZHEIMER'S DISEASE ASSAY IN A LIVING PATIENT CASSAVA SCIENCES, INC. 2014-01-16 US disclosed