SCHEMBL20003252

SCHEMBL20003252

CCNC(CC)CCCCCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
DNM1 Q05193 3/20 0.43
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
KDM4A O75164 5/20 0.30
KDM4C Q9H3R0 5/20 0.30
KDM5A P29375 1/20 0.30
KDM7A Q6ZMT4 1/20 0.30
PHF8 Q9UPP1 1/20 0.30
KDM2A Q9Y2K7 1/20 0.30
PRMT3 O60678 1/20 0.30
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
PRMT1 Q99873 1/20 0.30
PRMT8 Q9NR22 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
SCHEMBL12235888 0.86 DNM1 (0.58) ALDH1A1TSHRDNM1
SCHEMBL19786168 0.83 SLC6A4 (0.32)
SCHEMBL23457621 0.79 DNM1 (0.48) ALDH1A1TSHRDNM1
Bromide SCHEMBL19741466 0.79 DNM1 (0.38) ALDH1A1TSHRDNM1
SCHEMBL28268989 0.79 LMNA (0.39) TSHRDNM1
SCHEMBL10491044 0.79 LMNA (0.39) TSHRDNM1
SCHEMBL23686853 0.79 LMNA (0.39) TSHRDNM1
Hydrochloric Acid SCHEMBL29482100 0.77 LMNA (0.38) TSHRDNM1
SCHEMBL26511932 0.76 OPRM1 (0.39) ALDH1A1TSHRDNM1
SCHEMBL27818797 0.76 OPRM1 (0.39) ALDH1A1TSHRDNM1

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-2018057834-A1 COMBINATORY TREATMENT STRATEGIES OF CANCER BASED ON RNA POLYMERASE I INHIBITION THE JOHNS HOPKINS UNIVERSITY (US) 2018-03-29 WO disclosed