SCHEMBL28025522

SCHEMBL28025522

NCCCCC(N)(CN)CCCCN

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 2/20 0.44
DNM1 Q05193 6/20 0.41
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
LMNA P02545 2/20 0.41
BLM P54132 2/20 0.41
TSHR P16473 2/20 0.41
FDPS P14324 2/20 0.37
CYP2D6 P10635 1/20 0.33
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL421816 0.90 NFKB1 (0.38) NFKB1DNM1CA12CA1CA2
SCHEMBL2357721 0.84 NFKB1 (0.47) NFKB1DNM1CA12CA1CA2
SCHEMBL5366358 0.84 NFKB1 (0.47) NFKB1DNM1CA12CA1CA2
SCHEMBL20425510 0.84 DNM1 (0.53) NFKB1DNM1CA12CA1CA2
SCHEMBL28195932 0.82 CYP2D6 (0.33) NFKB1DNM1CA12CA1CA2
SCHEMBL28300322 0.81 DNM1 (0.50) NFKB1DNM1CA12CA1CA2
SCHEMBL7093120 0.81 DNM1 (0.50) NFKB1DNM1CA12CA1CA2
SCHEMBL817872 0.81 DNM1 (0.50) NFKB1DNM1CA12CA1CA2
SCHEMBL1275650 0.80
SCHEMBL817593 0.79 DNM1 (0.47) NFKB1DNM1CA12CA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103269826-B Lead-free solder scaling powder and lead-free solder paste 荒川化学工业株式会社 2016-12-07 CN disclosed
CN-102528326-B Rosin-based flux for soldering and solder paste ARAKAWA CHEM IND 2015-07-22 CN disclosed