SCHEMBL19085564

SCHEMBL19085564

C=C(CCC)CCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 6/20 0.44
ALDH1A1 P00352 3/20 0.39
TSHR P16473 1/20 0.39
LSS P48449 1/20 0.33
MAPT P10636 1/20 0.32
SLC6A4 P31645 1/20 0.31
PAOX Q6QHF9 1/20 0.31
CYP1A2 P05177 2/20 0.30
CYP2D6 P10635 1/20 0.30
HRH2 P25021 1/20 0.30
HRH4 Q9H3N8 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL19034541 0.85 DNM1 (0.36) DNM1ALDH1A1TSHRMAPTTDP1
SCHEMBL21698588 0.83 ALDH1A1 (0.41) DNM1ALDH1A1TSHRMAPTPAOX
SCHEMBL21698552 0.81 DNM1 (0.44) DNM1ALDH1A1TSHRMAPT
SCHEMBL4791412 0.79 DNM1 (0.48) DNM1ALDH1A1TSHR
SCHEMBL170759 0.79 DNM1 (0.48) DNM1ALDH1A1TSHR
SCHEMBL3810882 0.76
SCHEMBL21698745 0.76 ALDH1A1 (0.46) DNM1ALDH1A1TSHRPAOX
SCHEMBL73471 0.76
SCHEMBL25039586 0.76 DNM1 (0.40) DNM1ALDH1A1TSHRLSS
SCHEMBL140921 0.74 CES2 (0.46) ALDH1A1TSHRTDP1

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-2017117528-A1 LIPIDS AND LIPID NANOPARTICLE FORMULATIONS FOR DELIVERY OF NUCLEIC ACIDS Acuitas Therapeutics, Inc. (CA) 2017-07-06 WO disclosed