SCHEMBL15965441

SCHEMBL15965441

CCOCCOCC(O)COCCO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.64
USP2 O75604 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 1/20 0.43
HTT P42858 2/20 0.40
THRB P10828 2/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 5/20 0.39
MAPK1 P28482 1/20 0.39
LPAR5 Q9H1C0 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 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
SCHEMBL10710700 0.98 ALDH1A1 (0.61) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL10712147 0.93 ALDH1A1 (0.54) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL10867319 0.93 ALDH1A1 (0.54) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL10712690 0.93 ALDH1A1 (0.59) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL15965447 0.88 HSD17B10 (0.48) ALDH1A1USP2HSD17B10HTTTHRB
SCHEMBL2473398 0.86 HTT (0.53) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL2474890 0.86 HTT (0.53) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL18251584 0.85 MEN1 (0.61) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL5021533 0.85 MEN1 (0.61) ALDH1A1USP2MEN1KMT2AHSD17B10
SCHEMBL3542017 0.85 MEN1 (0.61) ALDH1A1USP2MEN1KMT2AHSD17B10

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