SCHEMBL8016458

SCHEMBL8016458

CCCCN(CCCC)CCn1nnnc1S

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
CYP1A2 P05177 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
SCHEMBL2979279 0.84 ALDH1A1 (0.35) HTTKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL5154397 0.82 HTT (0.45) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL21916037 0.81 HTT (0.35) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL1251275 0.80 SLC9A1 (0.42) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL8004195 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL10601434 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL10601672 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL6241128 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL6536864 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL7092801 0.79 SLC9A1 (0.44) HTTKMT2AMEN1CYP2C19ALDH1A1

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-6162575-A Process for making lithographic printing plate MITSUBISHI PAPER MILLS LIMITED (JP) 2000-12-19 US disclosed