SCHEMBL16798745

SCHEMBL16798745

CCCCC/C=C\C/C=C\CCCCCCCCOC(OCCCCCCCCC)C(C)N

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL2147225 1.00 ALDH1A1 (0.58) ALDH1A1CNR1CNR2KDM4E
SCHEMBL30296927 0.95 ALDH1A1 (0.54) ALDH1A1CNR1CNR2
SCHEMBL12462551 0.95 ALDH1A1 (0.50) ALDH1A1CNR1CNR2
SCHEMBL14715825 0.84 ALDH1A1 (0.68) ALDH1A1CNR1CNR2
SCHEMBL14715826 0.84 ALDH1A1 (0.68) ALDH1A1CNR1CNR2
SCHEMBL18923368 0.84 ALDH1A1 (0.68) ALDH1A1CNR1CNR2
SCHEMBL2176259 0.84 ALDH1A1 (0.62) ALDH1A1CNR1CNR2
SCHEMBL2176257 0.84 ALDH1A1 (0.62) ALDH1A1CNR1CNR2
SCHEMBL14834026 0.84 ALDH1A1 (0.62) ALDH1A1CNR1CNR2
SCHEMBL16902071 0.83 ALDH1A1 (0.65) ALDH1A1CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286318-A2 SARNA COMPOSITIONS AND METHODS OF USE Mina Therapeutics Limited (GB) 2018-02-28 EP disclosed
EP-3076994-A2 TARGETED ADAPTIVE VACCINES Moderna Therapeutics, Inc. (US) 2016-10-12 EP disclosed
WO-2015085318-A2 TARGETED ADAPTIVE VACCINES MODERNA THERAPEUTICS, INC. (US) 2015-06-11 WO disclosed