SCHEMBL651502

SCHEMBL651502

CCOC(=O)CCCCCOc1ccc2ccccc2c1C=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.65
GAA P10253 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
ADRB2 P07550 1/20 0.56
ADRB1 P08588 1/20 0.56
MAPT P10636 3/20 0.52
ALDH1A1 P00352 2/20 0.52
MITF O75030 1/20 0.52
LMNA P02545 1/20 0.52
HSP90AA1 P07900 1/20 0.52
PKM P14618 1/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TLR9 Q9NR96 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CNR2 P34972 4/20 0.47
TNF P01375 1/20 0.46

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
SCHEMBL655498 0.88 HPGD (0.53) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL10019288 0.88 HPGD (0.53) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL30066993 0.84 MAPT (0.69) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL24682906 0.84 L3MBTL1 (0.65) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL6715087 0.82 L3MBTL1 (0.89) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL5103995 0.82 L3MBTL1 (0.89) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL9484207 0.82 L3MBTL1 (0.89) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL8260594 0.80 PTGS2 (0.55) L3MBTL1GAATDP1MAPTALDH1A1
SCHEMBL24682276 0.80 L3MBTL1 (0.70) L3MBTL1GAATDP1ADRB2ADRB1
SCHEMBL3267360 0.80 L3MBTL1 (1.00) L3MBTL1GAATDP1ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022244317-A1 NITRILE OXIDE COMPOUND AND IONIC-FUNCTIONAL-GROUP-CONTAINING POLYMER 住友ゴム工業株式会社 2022-11-24 WO 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-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