SCHEMBL27975465

SCHEMBL27975465

CCCOCCC.OC1(O)CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.34
TSHR P16473 2/20 0.32
DPP4 P27487 1/20 0.31
EPHX2 P34913 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
SCHEMBL27975817 0.86 TSHR (0.48) TSHRDPP4EPHX2
SCHEMBL28146328 0.85 HTT (0.47) TSHREPHX2
Ether SCHEMBL28281502 0.80 SMN1; SMN2 (0.34) HSD17B10
Propane SCHEMBL27382508 0.79 ALDH1A1 (0.35)
Propane SCHEMBL9633151 0.79 ALDH1A1 (0.35)
SCHEMBL16544480 0.79 DRD3 (0.33) HSD17B10
Di(Hydroxyethyl)Ether SCHEMBL27926335 0.78 TSHR (0.50) TSHR
Decane SCHEMBL28834454 0.75 TSHR (0.42) HSD17B10TSHR
Ethylene Glycol SCHEMBL8732912 0.74 TSHR (0.48) HSD17B10TSHREPHX2
Methoxymethane SCHEMBL27975871 0.73 ALDH1A1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104069875-B A kind of dehydrogenation and preparation method thereof and a kind of method of dehydrogenating 岳阳昌德化工实业有限公司 2016-08-03 CN claimed
CN-104072342-A Dehydrogenation method of cyclohexanediol derivatives containing ether bonds Yueyang changde chemical industry co ltd 2014-10-01 CN claimed
CN-104069875-A Dehydrogenation catalyst, preparation method thereof, and dehydrogenation method Yueyang changde chemical industry co ltd 2014-10-01 CN claimed
CN-104926622-A Dehydrogenation method of cyclohexanediol and derivatives of cyclohexanediol Yueyang changde chemical industry co ltd 2015-09-23 CN disclosed
CN-104072342-A Dehydrogenation method of cyclohexanediol derivatives containing ether bonds Yueyang changde chemical industry co ltd 2014-10-01 CN disclosed
CN-104069875-A Dehydrogenation catalyst, preparation method thereof, and dehydrogenation method Yueyang changde chemical industry co ltd 2014-10-01 CN disclosed