SCHEMBL12374323

SCHEMBL12374323

CCCCCCc1ccc(C2(c3ccc(C)c(C(=O)OCC)c3)c3cc(C)ccc3-c3ccc(C)cc32)cc1C(=O)OCC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
NOD2 Q9HC29 1/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 2/20 0.35
LMNA P02545 2/20 0.33
TSHR P16473 3/20 0.33
ALDH1A1 P00352 2/20 0.33
PLK1 P53350 7/20 0.32
ELANE P08246 2/20 0.32
RARB P10826 1/20 0.32
PLK3 Q9H4B4 1/20 0.31

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
SCHEMBL10348289 0.85 MEN1 (0.42) KDM4EMEN1KMT2AUSP2LMNA
SCHEMBL12924815 0.82 PLK1 (0.40) PLK1RARBPLK3
SCHEMBL12924833 0.81 L3MBTL1 (0.37) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL14982364 0.81 MEN1 (0.33) MEN1KMT2A
SCHEMBL14982373 0.81 MEN1 (0.33) MEN1KMT2A
SCHEMBL13400867 0.81 PTPN11 (0.41) KDM4EMEN1KMT2ALMNATSHR
SCHEMBL13494970 0.81 PTPN11 (0.41) KDM4EMEN1KMT2ALMNATSHR
SCHEMBL14330046 0.80 ALDH1A1 (0.35) KDM4ENOD2MEN1KMT2AUSP2
SCHEMBL14982374 0.80 MEN1 (0.35) KDM4EMEN1KMT2AUSP2LMNA
SCHEMBL14982366 0.80 MEN1 (0.34) MEN1KMT2A

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-20110187266-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-04 US disclosed