SCHEMBL5358432

SCHEMBL5358432

NCCCCCCCCn1cccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
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
DNM1 Q05193 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
PIM1 P11309 1/20 0.39
TP53 P04637 1/20 0.37
NFKB1 P19838 1/20 0.37
TBXAS1 P24557 1/20 0.36
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL13295909 1.00 CA12 (0.42) CA12CA1CA2CA3CA4
SCHEMBL2284815 1.00 CA12 (0.42) CA12CA1CA2CA3CA4
SCHEMBL4623792 0.97 PIM1 (0.41) CA12CA1CA2CA3CA4
SCHEMBL644310 0.89
Hydrochloric Acid SCHEMBL3111252 0.86 TP53 (0.39) PIM1TP53NFKB1SIGMAR1
SCHEMBL27458343 0.86 TP53 (0.46) LMNATP53TBXAS1NPC1GALR3
SCHEMBL20465806 0.83 TP53 (0.48) LMNATSHRTP53TBXAS1NPC1
SCHEMBL536215 0.79 TP53 (0.37) LMNATP53TBXAS1NPC1GALR3
SCHEMBL536294 0.79 TP53 (0.37) LMNATP53TBXAS1NPC1GALR3
SCHEMBL129989 0.77

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
WO-2007149045-A1 COPOLYMER, MODIFIED POLYMER CARBOHYDRATE MATERIAL, MODIFIED BULD POLYMER, COMPOSITE MATERIAL, AND METHODS OF PREPARATION SWETREE TECHNOLOGIES AB (SE) 2007-12-27 WO disclosed
WO-2007147428-A1 COPOLYMER, MODIFIED POLYMER CARBOHYDRATE MATERIAL, MODIFIED BULK POLYMER, COMPOSITE MATERIAL, AND METHODS OF PREPARATION SWETREE TECHNOLOGIES AB (SE) 2007-12-27 WO disclosed