SCHEMBL3146877

SCHEMBL3146877

CCCCCCC(=O)/C=C\c1cc(F)cc(F)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.62
▸ IAPP P10997 3/20 0.54
▸ BACE1 P56817 1/20 0.51
▸ TOP2A P11388 2/20 0.45
▸ HTR1A P08908 1/20 0.45
▸ TRPA1 O75762 1/20 0.45
▸ POLB P06746 1/20 0.44
▸ POLA1 P09884 1/20 0.44
▸ PPARG P37231 2/20 0.43
▸ PPARA Q07869 2/20 0.43
▸ ESR1 P03372 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ PLA2G2A P14555 1/20 0.41
▸ PLA2G5 P39877 1/20 0.41
▸ ALOX12 P18054 1/20 0.40

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
SCHEMBL3146887 1.00 APP (0.62) APPIAPPBACE1TOP2AHTR1A
SCHEMBL8847657 0.81 APP (0.66) APPIAPPBACE1TOP2AHTR1A
SCHEMBL8847664 0.81 APP (0.66) APPIAPPBACE1TOP2AHTR1A
SCHEMBL23042776 0.79 APP (0.68) APPIAPPBACE1TOP2AHTR1A
SCHEMBL3399806 0.78 IAPP (0.65) APPIAPPTRPA1POLB
SCHEMBL3399802 0.78 IAPP (0.65) APPIAPPTRPA1POLB
SCHEMBL547240 0.78 APP (0.66) APPIAPPHTR1A
SCHEMBL17746768 0.78 APP (0.66) APPIAPPHTR1A
SCHEMBL157815 0.78 APP (0.66) APPIAPPHTR1A
SCHEMBL3398186 0.78 APP (0.66) APPIAPPHTR1A

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
EP-2152658-A2 ORGANIC COMPOUNDS AND COMPOSITIONS HAVING THE ABILITY TO MODULATE FRAGRANCE COMPOSITIONS Givaudan SA (CH) 2010-02-17 — — EP disclosed
WO-2008116338-A2 ORGANIC COMPOUNDS AND COMPOSITIONS HAVING THE ABILITY TO MODULATE FRAGRANCE COMPOSITIONS GIVAUDAN SA (CH) 2008-10-02 — — WO disclosed
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