SCHEMBL18746536

SCHEMBL18746536

CCOC(=O)CCCC/C=C\CCCCCCCCN

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.69
▸ CYP3A4 P08684 2/20 0.69
▸ ALOX15 P16050 1/20 0.69
▸ TSHR P16473 1/20 0.69
▸ HSD17B10 Q99714 1/20 0.69
▸ TDP1 Q9NUW8 1/20 0.69
▸ CYP1A2 P05177 2/20 0.67
▸ NR1I2 O75469 1/20 0.58
▸ PGR P06401 1/20 0.58
▸ ADORA3 P0DMS8 1/20 0.58
▸ PTGS2 P35354 1/20 0.58
▸ PDE4D Q08499 1/20 0.58
▸ MAPT P10636 1/20 0.55
▸ THRB P10828 1/20 0.55
▸ CNR1 P21554 1/20 0.55
▸ FAAH O00519 3/20 0.53
▸ SLC6A5 Q9Y345 2/20 0.51
▸ DGKA P23743 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ TP53 P04637 1/20 0.49

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
SCHEMBL17244801 1.00 ALDH1A1 (0.69) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
Ethyl Oleate SCHEMBL28248089 0.95 ALDH1A1 (0.63) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
Ethyl Oleate SCHEMBL27479328 0.95 ALDH1A1 (0.63) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
Dectaflur SCHEMBL22689506 0.95 ALDH1A1 (0.63) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL23595590 0.91 ALOX15 (0.80) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL15442495 0.91 ALOX15 (0.80) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL15445279 0.91 ALOX15 (0.80) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL15457464 0.91 ALOX15 (0.80) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL15442493 0.91 ALOX15 (0.80) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1471510 0.89 CYP1A2 (0.83) ALDH1A1CYP3A4ALOX15TSHRHSD17B10

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
EP-2575764-B1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS INC (US) 2017-04-19 — — EP disclosed
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