SCHEMBL13812550

SCHEMBL13812550

CC(=O)Nc1cc(Cl)ccc1C(=O)Nc1cccc(OCCc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 5/20 0.52
▸ MAPT P10636 2/20 0.52
▸ NR1H4 Q96RI1 2/20 0.51
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ GRIK1 P39086 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ TP53 P04637 1/20 0.48
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MET P08581 1/20 0.47
▸ PPARG P37231 1/20 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
SCHEMBL13812584 0.92 MEN1 (0.53) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812552 0.87 SIRT2 (0.52) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812551 0.85 SIRT2 (0.52) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812546 0.85 SIRT2 (0.59) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL3863657 0.83 P2RX1 (0.62) SIRT2NR1H4MEN1KMT2ANPC1
SCHEMBL13812586 0.83 NR1H4 (0.50) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812764 0.83 LRRK2 (0.55) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812545 0.82 MEN1 (0.55) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812547 0.81 MEN1 (0.55) SIRT2MAPTNR1H4MEN1KMT2A
SCHEMBL13812799 0.79 NR1H4 (0.50) SIRT2MAPTNR1H4MEN1KMT2A

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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