SCHEMBL18180919

SCHEMBL18180919

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

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL18180939 0.78 — —
SCHEMBL18180918 0.76 MEN1 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180912 0.76 MEN1 (0.33) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180911 0.73 MEN1 (0.31) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180915 0.69 MEN1 (0.32) MEN1ALDH1A1MAPTKMT2A
SCHEMBL18180884 0.64 MAPT (0.37) MEN1ALDH1A1MAPTKMT2A
SCHEMBL10307515 0.62 — —
SCHEMBL18180928 0.61 — —
SCHEMBL18180936 0.60 — —
SCHEMBL13822287 0.59 CYP3A4 (0.31) —

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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