SCHEMBL28070811

SCHEMBL28070811

CCC(C)C(CC)C(O)O

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
TDP1 Q9NUW8 1/20 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
SCHEMBL17581954 0.81 TSHR (0.44) TSHRTDP1
SCHEMBL7910340 0.81 TSHR (0.44) TSHRTDP1
SCHEMBL9788212 0.80 TSHR (0.38) TSHR
SCHEMBL4655213 0.79 TSHR (0.38) TSHR
SCHEMBL7047461 0.79
SCHEMBL2946881 0.76
SCHEMBL111180 0.76
SCHEMBL2948663 0.76
SCHEMBL27956275 0.75 TSHR (0.38) TSHRTDP1
SCHEMBL598087 0.73 TSHR (0.33) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105670885-B A kind of \"Hami\" melon sea buckthorn brandy and preparation method thereof 山东省农业科学院农产品研究所 2018-09-28 CN claimed
CN-105670885-B A kind of \"Hami\" melon sea buckthorn brandy and preparation method thereof 山东省农业科学院农产品研究所 2018-09-28 CN disclosed
CN-105670885-A Hami melon/sea buckthorn brandy and preparation method thereof 山东省农业科学院农产品研究所 2016-06-15 CN disclosed