SCHEMBL3792304

SCHEMBL3792304

NCCCCCC(CCCN)(CCCCN)CCCCN

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.53
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA3 P07451 2/20 0.53
CA4 P22748 2/20 0.53
CA6 P23280 2/20 0.53
CA5A P35218 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
CA5B Q9Y2D0 2/20 0.53
TSHR P16473 2/20 0.53
LMNA P02545 1/20 0.53
BLM P54132 1/20 0.53
NFKB1 P19838 1/20 0.47
FDPS P14324 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL18694932 0.89 NFKB1 (0.46) DNM1CA12CA1CA2CA3
SCHEMBL28276118 0.84 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL5874836 0.83 DNM1 (0.60) DNM1CA12CA1CA2CA3
SCHEMBL3281684 0.83 DNM1 (0.68) DNM1CA12CA1CA2CA3
SCHEMBL30261766 0.83 DNM1 (0.68) DNM1CA12CA1CA2CA3
SCHEMBL10404133 0.83 NFKB1 (0.40) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL5352701 0.81 DNM1 (0.40) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL11839228 0.81 DNM1 (0.70) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL5350159 0.81 DNM1 (0.40) DNM1CA12CA1CA2CA3
Bromide SCHEMBL1461566 0.81 DNM1 (0.70) DNM1CA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790234-B2 Low dielectric constant materials prepared from soluble fullerene clusters XYLON LLC 2010-09-07 US claimed
US-20080044642-A1 Low dielectric constant materials prepared from soluble fullerene clusters ROSKILDE SEMICONDUCTOR, LLC (US) 2008-02-21 US claimed
WO-2007143028-A2 LOW DIELECTRIC CONSTANT MATERIALS PREPARED FROM SOLUBLE FULLERENE CLUSTERS ROSKILDE SEMICONDUCTOR LLC (US) 2007-12-13 WO claimed
US-7790234-B2 Low dielectric constant materials prepared from soluble fullerene clusters XYLON LLC 2010-09-07 US disclosed
US-20080044642-A1 Low dielectric constant materials prepared from soluble fullerene clusters ROSKILDE SEMICONDUCTOR, LLC (US) 2008-02-21 US disclosed
WO-2007143028-A2 LOW DIELECTRIC CONSTANT MATERIALS PREPARED FROM SOLUBLE FULLERENE CLUSTERS ROSKILDE SEMICONDUCTOR LLC (US) 2007-12-13 WO disclosed