SCHEMBL8015113

SCHEMBL8015113

NCCNCCOCCNCCN

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.62
CA6 P23280 5/20 0.62
CA7 P43166 5/20 0.62
CA9 Q16790 5/20 0.62
CA14 Q9ULX7 5/20 0.62
CA5B Q9Y2D0 5/20 0.62
MEN1 O00255 2/20 0.62
RECQL P46063 2/20 0.62
KMT2A Q03164 2/20 0.62
CA2 P00918 4/20 0.59
CA4 P22748 4/20 0.59
CA5A P35218 4/20 0.59
LMNA P02545 3/20 0.59
CA3 P07451 3/20 0.59
ALOX15 P16050 3/20 0.59
TDP1 Q9NUW8 2/20 0.59
CA1 P00915 2/20 0.59
ALDH1A1 P00352 1/20 0.59
TP53 P04637 1/20 0.59
KDM4E B2RXH2 1/20 0.56

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
SCHEMBL8874005 0.94 CA12 (0.56) CA12CA6CA7CA9CA14
SCHEMBL11534165 0.88 CA12 (0.48) CA12CA6CA7CA9CA14
SCHEMBL770197 0.88 CA12 (0.44) CA12CA6CA7CA9CA14
SCHEMBL394398 0.87 CA12 (0.48) CA12CA6CA7CA9CA14
SCHEMBL9349287 0.87 CA12 (0.48) CA12CA6CA7CA9CA14
SCHEMBL9065706 0.87 CA12 (0.48) CA12CA6CA7CA9CA14
SCHEMBL11443099 0.86 CA12 (0.46) CA12CA6CA7CA9CA14
SCHEMBL18217828 0.86 CA12 (0.58) CA12CA6CA7CA9CA14
SCHEMBL24040362 0.85 MEN1 (0.50) CA12CA6CA7CA9CA14
SCHEMBL22905617 0.85 CA12 (0.50) CA12CA6CA7CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0512423-B1 Aqueous solutions of cationic polyamidoamine resins HOECHST AG (DE) 1998-07-22 EP claimed
US-6022449-A HIGHER RETENTION BUT ALSO TO IMPROVED DRY AND WET STRENGTH AND SIZING. BAYER AKTIENGESELLSCHAFT (DE) 2000-02-08 US disclosed
EP-0671418-B1 Hydrophilic hydrogels having a high swelling capacity CLARIANT GMBH (DE) 1998-08-12 EP disclosed
EP-0512423-B1 Aqueous solutions of cationic polyamidoamine resins HOECHST AG (DE) 1998-07-22 EP disclosed
US-5668236-A Hydrophilic highly swellable hydrogels CASSELLA AKTIENGESELLSCHAFT (DE) 1997-09-16 US disclosed
EP-0671418-A2 Hydrophilic hydrogels having a high swelling capacity HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-13 EP disclosed
EP-0512423-A2 Aqueous solutions of cationic polyamidoamine resins HOECHST AKTIENGESELLSCHAFT (DE) 1992-11-11 EP disclosed