SCHEMBL3622874

SCHEMBL3622874

CCCCCCC1NC(=O)C(CCCCCC)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HLCS P50747 2/20 0.42
CYP1A2 P05177 3/20 0.40
DNTT P04053 1/20 0.37
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
TPSAB1 Q15661 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35
NAAA Q02083 3/20 0.35
MMP1 P03956 1/20 0.35
MMP3 P08254 1/20 0.35

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
SCHEMBL8998181 0.98 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL5442521 0.98 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL10005090 0.98 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL15298459 0.95 ALDH1A1 (0.48) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL5452034 0.95
SCHEMBL14457494 0.91 ALDH1A1 (0.52) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL15044732 0.89 GPR84 (0.37) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL931066 0.88
Hydrochloric Acid SCHEMBL11837152 0.86
SCHEMBL11846844 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100038592-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION SUMATION CO., LTD. (JP) 2010-02-18 US disclosed
US-20100038592-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION SUMATION CO., LTD. (JP) 2010-02-18 US disclosed
CN-101611092-A Composition and light emitting device comprising the same SUMITOMO CHEMICAL CO (JP) 2009-12-23 CN disclosed
EP-2103653-A1 COMPOSITION AND LIGHT-EMITTING ELEMENT COMPRISING THE COMPOSITION Sumitomo Chemical Company, Limited (JP) 2009-09-23 EP disclosed