SCHEMBL13579197

SCHEMBL13579197

CNC(=O)c1ccc(-c2ccc(C(=O)O)c(C(=O)Nc3ccc(C)cc3)c2)cc1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ GAA P10253 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ GFER P55789 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SORT1 Q99523 2/20 0.46
▸ RAB9A P51151 6/20 0.44
▸ NPC1 O15118 5/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 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
SCHEMBL9885179 0.97 MCL1 (0.49) ALDH1A1MEN1KMT2ACYP1A2TDP1
SCHEMBL17268315 0.97 TDP1 (0.50) ALDH1A1MEN1KMT2ACYP1A2TDP1
SCHEMBL13579198 0.93 MAPK1 (0.58) ALDH1A1MEN1KMT2ATDP1GAA
SCHEMBL20370268 0.90 MAPK1 (0.55) ALDH1A1MEN1KMT2ATDP1GAA
SCHEMBL9885177 0.90 MAPK1 (0.57) ALDH1A1MEN1KMT2ATDP1GAA
SCHEMBL9885133 0.89 RAB9A (0.51) ALDH1A1MEN1KMT2ACYP1A2TDP1
SCHEMBL15503331 0.87 RAB9A (0.53) ALDH1A1MEN1KMT2ATDP1GFER
SCHEMBL18056772 0.86 SMN1; SMN2 (0.49) ALDH1A1MEN1KMT2ATDP1GFER
SCHEMBL17298044 0.86 KMT2A (0.46) ALDH1A1MEN1KMT2ACYP1A2TDP1
SCHEMBL15294834 0.86 MAPK1 (0.61) ALDH1A1MEN1KMT2ATDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090305129-A1 LITHIUM SECONDARY BATTERY AND METHOD OF MANUFACTURING THE SAME SANYO ELECTRIC CO., LTD. (JP) 2009-12-10 — — US disclosed
Send feedback