SCHEMBL655423

SCHEMBL655423

CCOC(=O)CCCCCOc1ccc2ccccc2c1C#[N+][O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.43
TNF P01375 1/20 0.43
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
MITF O75030 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HSP90AA1 P07900 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TLR9 Q9NR96 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
CNR1 P21554 5/20 0.41
TOP2A P11388 1/20 0.39
CYP2C9 P11712 1/20 0.39
GAA P10253 1/20 0.38

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
SCHEMBL2430976 0.84 KCNA3 (0.43) CNR2CNR1CYP2C9GAATDP1
SCHEMBL651502 0.78 L3MBTL1 (0.65) CNR2TNFCYSLTR2CYSLTR1MITF
SCHEMBL8260594 0.77 PTGS2 (0.55) CNR2TNFCYSLTR2CYSLTR1MITF
SCHEMBL655498 0.75 HPGD (0.53) CNR2TNFCYSLTR2CYSLTR1MITF
SCHEMBL10019288 0.75 HPGD (0.53) CNR2TNFCYSLTR2CYSLTR1MITF
SCHEMBL12290140 0.73 MAPT (0.36) ALDH1A1LMNAMAPTHPGDNPSR1
SCHEMBL22610040 0.73 PTGS2 (0.56) CNR2TNFCYSLTR2CYSLTR1MITF
SCHEMBL22092054 0.72 CYP4F2 (0.56) TNFCYSLTR2CYSLTR1ALDH1A1CYP4F2
SCHEMBL22091835 0.72 CYP4F2 (0.56) TNFCYSLTR2CYSLTR1ALDH1A1CYP4F2
SCHEMBL22091796 0.72 CYP4F2 (0.56) TNFCYSLTR2CYSLTR1ALDH1A1CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507611-B2 Crosslinkable polymer material, crosslinked polymer material, and production method thereof TOYODA GOSEI CO., LTD. (JP) 2013-08-13 US claimed
US-20120046418-A1 CROSSLINKABLE POLYMER MATERIAL, CROSSLINKED POLYMER MATERIAL, AND PRODUCTION METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-23 US claimed
US-8507611-B2 Crosslinkable polymer material, crosslinked polymer material, and production method thereof TOYODA GOSEI CO., LTD. (JP) 2013-08-13 US disclosed
US-8507611-B2 Crosslinkable polymer material, crosslinked polymer material, and production method thereof TOYODA GOSEI CO., LTD. (JP) 2013-08-13 US disclosed
US-8507611-B2 Crosslinkable polymer material, crosslinked polymer material, and production method thereof TOYODA GOSEI CO., LTD. (JP) 2013-08-13 US disclosed
US-20120046418-A1 CROSSLINKABLE POLYMER MATERIAL, CROSSLINKED POLYMER MATERIAL, AND PRODUCTION METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-23 US disclosed
US-20120046418-A1 CROSSLINKABLE POLYMER MATERIAL, CROSSLINKED POLYMER MATERIAL, AND PRODUCTION METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-23 US disclosed
US-20120046418-A1 CROSSLINKABLE POLYMER MATERIAL, CROSSLINKED POLYMER MATERIAL, AND PRODUCTION METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-23 US disclosed