SCHEMBL15965455

SCHEMBL15965455

COCCOCCOCCOCCNCCOCCO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
TSHR P16473 4/20 0.46
MAPK1 P28482 1/20 0.46
KDM4E B2RXH2 5/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 6/20 0.41
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 1/20 0.34
ADRB2 P07550 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL15033000 1.00 MEN1 (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL15965476 1.00 MEN1 (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL15965445 1.00 MEN1 (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL18364979 0.95 MEN1 (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL14410937 0.93 TSHR (0.48) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL27254437 0.91 TSHR (0.46) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL21146862 0.91 TSHR (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL15965454 0.91 TSHR (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL18306252 0.91 TSHR (0.50) MEN1KMT2ATSHRMAPK1KDM4E
SCHEMBL18364912 0.90 MEN1 (0.48) MEN1KMT2ATSHRMAPK1KDM4E

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-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed