SCHEMBL18180915

SCHEMBL18180915

C=C1CC(OC)C2C(OC(=O)C2(CCl)OC)C2C1CC(OC)C2C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL18180937 0.75 — —
SCHEMBL18180919 0.69 MEN1 (0.34) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180918 0.66 MEN1 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180912 0.66 MEN1 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180911 0.65 MEN1 (0.31) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180868 0.54 MAPT (0.36) MEN1ALDH1A1MAPTKMT2A
SCHEMBL10307515 0.53 — —
SCHEMBL11758161 0.51 CYP2D6 (0.32) MAPT
SCHEMBL10307520 0.50 MAPT (0.35) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180889 0.50 MAPT (0.35) MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016169573-A1 SESQUITERPENE LACTONES AS POTENT AND BROAD SPECTRUM ANTIVIRAL COMPOUNDS AGAINST ALL GENOTYPES OF HEPATITIS C VIRUS (HCV) ELSEBAI MAHMOUD FAHMI (EG) 2016-10-27 — — WO disclosed
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