SCHEMBL4274167

SCHEMBL4274167

CC1(C)C2CC=C(COC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C1C2

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SYNJ2 O15056 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SLC5A2 P31639 1/20 0.40
▸ TYR P14679 1/20 0.40
▸ POLB P06746 1/20 0.39

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
SCHEMBL30493186 0.84 ACHE (0.44) ACHEKDM4ETSHRHTTTDP1
SCHEMBL15798293 0.69 KCNH2 (0.51) KDM4ETSHRHTTTDP1MAPK1
SCHEMBL30712746 0.69 ACHE (0.46) ACHESLC5A2TYRPOLB
Myrtenol SCHEMBL820534 0.69 TSHR (0.58) KDM4ETSHRHTTTDP1MAPK1
Myrtenol SCHEMBL24281940 0.69 TSHR (0.58) KDM4ETSHRHTTTDP1MAPK1
SCHEMBL14975517 0.68 SLC5A2 (0.61) ACHESLC5A2TYR
SCHEMBL14975518 0.68 SLC5A2 (0.61) ACHESLC5A2TYR
SCHEMBL16227542 0.68 SLC5A2 (0.61) ACHESLC5A2TYR
SCHEMBL15445238 0.67 TDP1 (0.46) KDM4ETSHRHTTTDP1MAPK1
SCHEMBL112577 0.66 TDP1 (0.49) KDM4ETSHRHTTTDP1MAPK1

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
US-20090031455-A1 TERPENE HYDROXYLATION PLANT RESEARCH INTERNATIONAL B.V. (NL) 2009-01-29 — — US disclosed
EP-1805311-A2 TERPENE HYDROXYLATION Plant Research International B.V. (NL) 2007-07-11 — — EP disclosed
WO-2006065126-A2 TERPENE HYDROXYLATION PLANT RESEARCH INTERNATIONAL B.V. (NL) 2006-06-22 — — WO disclosed
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