SCHEMBL21901404

SCHEMBL21901404

CC1CCCCC(C)(CN)CCCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL18754413 0.98 ACHE (0.32) SLC6A4SLC6A3KDM4E
SCHEMBL22421635 0.96 CYP1A2 (0.32) SLC6A4SLC6A3
SCHEMBL18430817 0.85 CYP1A2 (0.34)
SCHEMBL24376136 0.83 KDM4E (0.31) KDM4E
SCHEMBL3249011 0.83
SCHEMBL29151816 0.80 CYP1A2 (0.40)
SCHEMBL13849408 0.80 USP2 (0.36) SLC6A4SLC6A3
SCHEMBL19242261 0.80 USP2 (0.36) SLC6A4SLC6A3
SCHEMBL5118439 0.80 USP2 (0.36) SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL23175096 0.80

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-2020081744-A1 IMMUNOMODULATING POLYNUCLEOTIDE CONJUGATES AND METHODS OF USE TOLLNINE, INC. (US) 2020-04-23 WO disclosed