SCHEMBL20795023

SCHEMBL20795023

CCCCC/C=C/CC1C(=O)C=CC1C/C=C/CCCC(=O)NCCO

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 5/20 0.61
▸ CNR2 P34972 4/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ BLM P54132 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ TRPV1 Q8NER1 2/20 0.61
▸ FAAH O00519 2/20 0.61
▸ TRPM8 Q7Z2W7 1/20 0.61
▸ KCNK3 O14649 1/20 0.61
▸ HPGD P15428 2/20 0.57
▸ MAPT P10636 1/20 0.57
▸ ALOX12 P18054 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57

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
SCHEMBL19732190 0.83 TRPA1 (0.64) ALDH1A1MEN1BLMKMT2AHPGD
SCHEMBL10865636 0.81 MAPT (0.75) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL10866480 0.81 MAPT (0.75) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL20794836 0.78 ALDH1A1 (0.73) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL16661496 0.78 ALDH1A1 (0.73) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL30600367 0.78 CNR1 (0.78) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL29726562 0.78 CNR1 (0.78) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL29927289 0.78 CNR1 (0.78) CNR1CNR2ALDH1A1MEN1BLM
SCHEMBL29926596 0.78 CNR1 (0.78) CNR1CNR2ALDH1A1MEN1BLM
Anandamide SCHEMBL4109856 0.77 CNR1 (1.00) CNR1CNR2ALDH1A1MEN1BLM

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-2019046556-A1 COMPOUNDS, COMPOSITIONS, KITS, AND METHODS FOR ACTIVATING IMMUNE CELLS AND/OR AN IMMUNE SYSTEM RESPONSE EAST CAROLINA UNIVERSITY (US) 2019-03-07 — — WO disclosed
Send feedback