SCHEMBL13812551

SCHEMBL13812551

CC(=O)Nc1cc(F)c(F)cc1C(=O)Nc1cccc(OCCc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 6/20 0.52
▸ NR1H4 Q96RI1 1/20 0.52
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ MAPT P10636 2/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ AHR P35869 1/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ LMNA P02545 2/20 0.46

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
SCHEMBL13812553 0.87 SIRT2 (0.51) SIRT2NR1H4MAPTSMN1; SMN2NPC1
SCHEMBL13812546 0.85 SIRT2 (0.59) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812584 0.85 MEN1 (0.53) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812550 0.85 SIRT2 (0.52) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812547 0.81 MEN1 (0.55) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812545 0.81 MEN1 (0.55) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812748 0.79 NR1H4 (0.55) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812756 0.79 NR1H4 (0.55) SIRT2NR1H4MEN1KMT2AMAPT
SCHEMBL13812761 0.78 SIRT2 (0.60) SIRT2NR1H4MEN1KMT2ANPC1
SCHEMBL13812586 0.78 NR1H4 (0.50) SIRT2NR1H4MEN1KMT2AMAPT

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-7547804-B2 Compounds, compositions, and methods employing same MYRIAD GENETICS, INC. (US) 2009-06-16 — — US disclosed
US-7547804-B2 Compounds, compositions, and methods employing same MYRIAD GENETICS, INC. (US) 2009-06-16 — — US disclosed
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