SCHEMBL13866797

SCHEMBL13866797

CNc1ccc(NC(=O)c2cc(-c3ccc(C(=O)O)c(C(=O)Nc4ccc(Oc5ccc(NC(=O)c6cc(-c7ccc(C(=O)O)c(C(C)=O)c7)ccc6C(=O)O)cc5)cc4)c3)ccc2C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ GFER P55789 1/20 0.52
▸ TDP1 Q9NUW8 4/20 0.51
▸ LMNA P02545 3/20 0.48
▸ POLB P06746 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ FNTA P49354 1/20 0.46
▸ FNTB P49356 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ PNLIP P16233 3/20 0.45
▸ GALK1 P51570 1/20 0.45
▸ CASP6 P55212 1/20 0.45
▸ MCL1 Q07820 1/20 0.45
▸ PLEC Q15149 1/20 0.45
▸ NR1H4 Q96RI1 1/20 0.44

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
SCHEMBL13870130 1.00 MEN1 (0.52) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL12368078 0.90 MAPK1 (0.46) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL12539660 0.90 MEN1 (0.53) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL16775508 0.88 ALDH1A1 (0.50) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL12368079 0.85 MAPK1 (0.52) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL13878438 0.85 TDP1 (0.59) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL9885177 0.84 MAPK1 (0.57) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL19398281 0.83 MEN1 (0.55) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL20370268 0.82 MAPK1 (0.55) MEN1KMT2AL3MBTL1MAPK1GFER
SCHEMBL21675646 0.82 MEN1 (0.49) MEN1KMT2AL3MBTL1MAPK1GFER

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-7517553-B2 Adhesive aid composition NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-14 — — US disclosed
US-20070026227-A1 Adhesive aid composition NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-02-01 — — US disclosed
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