SCHEMBL6903115

SCHEMBL6903115

NCCCCCCCCCCCCCCCC(CCO)CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 2/20 0.42
BLM P54132 1/20 0.42
GSR P00390 1/20 0.39
CPB2 Q96IY4 3/20 0.39
RNPEP Q9H4A4 1/20 0.38
NFKB1 P19838 1/20 0.37
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL1684293 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL474837 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL8077976 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL6899876 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL3068723 0.97 GSR (0.41) DNM1CA12CA1CA2CA3
SCHEMBL11806737 0.90 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL3073650 0.89 TSHR (0.39) DNM1CA12CA1CA2CA3
SCHEMBL14830612 0.87 GSR (0.33) LMNATSHRGSRCPB2RNPEP
SCHEMBL21490305 0.87 SLC6A5 (0.39) DNM1CA12CA1CA2CA3
SCHEMBL588277 0.87 SLC6A5 (0.39) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023153302-A1 CYCLIC OLEFIN RESIN COMPOSITION, MOLDED ARTICLE AND OPTICAL COMPONENT 三井化学株式会社 2023-08-17 WO disclosed
EP-1081187-B1 Rubber composition containing silica or silicate and salt of an amine BRIDGESTONE CORP (JP) 2004-02-18 EP disclosed
US-6355710-B1 MIXTURE WITH FILLER AND AMINE SALT BRIDGESTONE CORPORATION (JP) 2002-03-12 US disclosed
EP-1081187-A2 Rubber composition containing silica or silicate and salt of an amine BRIDGESTONE CORPORATION (JP) 2001-03-07 EP disclosed