SCHEMBL28084246

SCHEMBL28084246

COC=CCc1cccc(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.56
AGXT P21549 2/20 0.56
TAAR1 Q96RJ0 3/20 0.51
CHRM2 P08172 3/20 0.49
CHRM1 P11229 3/20 0.49
CHRM3 P20309 3/20 0.49
CMA1 P23946 1/20 0.47
ACHE P22303 1/20 0.47
MAOB P27338 3/20 0.46
SIGMAR1 Q99720 1/20 0.46
AOC3 Q16853 1/20 0.46
LPO P22079 1/20 0.45

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
SCHEMBL27610564 0.82 IDO1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL28224567 0.82 IDO1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL29624521 0.82 IDO1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL6158441 0.82 IDO1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL28743543 0.82 IDO1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL8305017 0.81 TAAR1 (0.58) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL28811906 0.80 MTNR1A (0.50) IDO1AGXTTAAR1
SCHEMBL248658 0.79 CHRM2 (0.57) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL3503547 0.79 TAAR1 (0.56) IDO1AGXTTAAR1CHRM2CHRM1
SCHEMBL28251027 0.79 RELA (0.57) IDO1AGXTCHRM2CHRM1CHRM3

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
CN-105918946-B Jujube-wolfberry liver-nourishing composition, granules and preparation method thereof 好想你健康食品股份有限公司 2019-12-31 CN disclosed
CN-105918946-A Red date and Chinese wolfberry fruit liver tonifying composition, granules and preparation method thereof 好想你枣业股份有限公司 2016-09-07 CN disclosed