SCHEMBL20032065

SCHEMBL20032065

CCCC(CCN(C)C)NCCCN(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.38
TDP1 Q9NUW8 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
PAOX Q6QHF9 1/20 0.31
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL15558978 0.87 DNM1 (0.48) DNM1TDP1SIGMAR1ALDH1A1TSHR
SCHEMBL18221733 0.82 DNM1 (0.52) DNM1TDP1ALDH1A1TSHRPAOX
SCHEMBL13976195 0.82 DNM1 (0.52) DNM1TDP1ALDH1A1TSHRPAOX
SCHEMBL14524679 0.82 DNM1 (0.33) DNM1TDP1SIGMAR1
SCHEMBL18158076 0.82 TDP1 (0.38) DNM1TDP1ALDH1A1TSHRPAOX
SCHEMBL25341927 0.77 DNM1 (0.45) DNM1ALDH1A1TSHRPAOXMEN1
SCHEMBL23457621 0.76 DNM1 (0.48) DNM1TDP1ALDH1A1TSHRPAOX
SCHEMBL19214727 0.75 DNM1 (0.44) DNM1TDP1ALDH1A1TSHR
SCHEMBL5349650 0.75 SIGMAR1 (0.43) TDP1SIGMAR1ALDH1A1TSHRMEN1
SCHEMBL19090812 0.75 LMNA (0.38) DNM1TDP1SIGMAR1ALDH1A1CYP2C9

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
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed