SCHEMBL23587808

SCHEMBL23587808

CNCC(O)CNCCC(O)COC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.35
KDM4E B2RXH2 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 2/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
ALOX15 P16050 1/20 0.33
ADRB3 P13945 2/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
ABCB1 P08183 2/20 0.30

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
SCHEMBL23587805 0.84 KDM4E (0.43) POLBMAPTKDM4EKMT2AALDH1A1
SCHEMBL23587804 0.82
SCHEMBL24840309 0.82 MAPT (0.31) POLBMAPT
SCHEMBL2891621 0.80
SCHEMBL16089122 0.80
SCHEMBL2891619 0.80
SCHEMBL23587806 0.79 KDM4E (0.39) POLBMAPTKDM4EKMT2AALDH1A1
SCHEMBL3030823 0.73 KISS1R (0.35) KDM4EALDH1A1ALOX15
SCHEMBL16582259 0.73 KDM4E (0.52) POLBMAPTKDM4EKMT2AALDH1A1
SCHEMBL4845743 0.72 KDM4E (0.48) POLBMAPTKDM4EKMT2AALDH1A1

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
WO-2023276954-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM 昭和電工株式会社 2023-01-05 WO disclosed
WO-2021132252-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIA, AND MAGNETIC RECORDING MEDIUM 昭和電工株式会社 2021-07-01 WO disclosed