SCHEMBL4382238

SCHEMBL4382238

CCCCC(CC)COc1cc(Br)c(-c2ccccc2)cc1OCC(CC)CCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
CYP3A4 P08684 3/20 0.42
CA2 P00918 1/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 1/20 0.39
LMNA P02545 3/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
MAPK1 P28482 3/20 0.37
KDM4E B2RXH2 1/20 0.36
TSHR P16473 1/20 0.36
PTGES O14684 1/20 0.36
ALOX5 P09917 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
SOAT1 P35610 1/20 0.34
PTPN1 P18031 2/20 0.34

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
SCHEMBL6251007 0.94 ALDH1A1 (0.41) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL28083440 0.83 CYP3A4 (0.43) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL2053675 0.80 CYP3A4 (0.43) ALDH1A1CYP3A4CA2L3MBTL1LMNA
SCHEMBL27735085 0.80 ALDH1A1 (0.42) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL27714379 0.79 KMT2A (0.53) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL16432304 0.78 CYP3A4 (0.39) ALDH1A1CYP3A4CA2L3MBTL1LMNA
SCHEMBL7645902 0.78 HTR2A (0.43) ALDH1A1CYP3A4CA2L3MBTL1MAPK1
SCHEMBL17403685 0.78 ALDH1A1 (0.40) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL17403681 0.78 ALDH1A1 (0.50) ALDH1A1CYP3A4CA2MEN1KMT2A
SCHEMBL1777606 0.77 ALDH1A1 (0.55) ALDH1A1CYP3A4CA2MEN1KMT2A

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-7482067-B2 Electroluminescent device using metal nanoparticles SAMSUNG SDI CO., LTD. (KR) 2009-01-27 US disclosed
US-20050276993-A1 Electroluminescent device using metal nanoparticles SAMSUNG DISPLAY CO., LTD. (KR) 2005-12-15 US disclosed