SCHEMBL4797374

SCHEMBL4797374

CCCC[AlH]CC(=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD11B1 P28845 1/20 0.41
CYP1A2 P05177 2/20 0.41
ALDH1A1 P00352 2/20 0.41
NAAA Q02083 2/20 0.40
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ASAH1 Q13510 2/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP2D6 P10635 1/20 0.38
ACER2 Q5QJU3 1/20 0.38
PAX8 Q06710 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL4806564 0.94 NAAA (0.44) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4796088 0.94 NAAA (0.44) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4805412 0.86 KDM4E (0.44) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4802976 0.83 HSD11B1 (0.46) MEN1KMT2ATDP1SMN1; SMN2HSD11B1
SCHEMBL4801261 0.81 UBE2N (0.50) POLBCHRM1
SCHEMBL4801350 0.80 ASAH1 (0.45) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4803912 0.80 ASAH1 (0.45) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL28438991 0.78 MEN1 (0.54) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4801388 0.77 HSD11B1 (0.41) MEN1KMT2ATDP1KDM4EHTT
SCHEMBL4805598 0.77 TDP1 (0.43) MEN1KMT2ATDP1KDM4EHTT

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-7388059-B2 Ethylene polymer, catalyst for producing thereof and method for producing thereof JAPAN POLYETHYLENE CORPORATION (JP) 2008-06-17 US disclosed
US-20050288459-A1 Ethylene polymer, catalyst for producing thereof and method for producing thereof JAPAN POLYETHYLENE CORPORATION (JP) 2005-12-29 US disclosed