SCHEMBL2593084

SCHEMBL2593084

NCCCCCCCCCCCC(N)C(N)CCCCCCCCCCN

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 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
GSR P00390 1/20 0.46
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
SCHEMBL16402420 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL11212697 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL16398441 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL11214909 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL11207922 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL23034836 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL6722184 1.00 DNM1 (0.53) DNM1CA12CA1CA2CA3
SCHEMBL11211285 0.97 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL6344403 0.97 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL11216747 0.97 DNM1 (0.50) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1659449-A2 Low-temperature curable photosensitive compositions E.I.Du pont de nemours and company (US) 2006-05-24 EP claimed
EP-3927758-A1 NOVEL TWO-COMPONENT CLEAR COAT SYSTEMS CONTAINING POLYASPARTIC ACID ESTER Covestro Intellectual Property GmbH & Co. KG (DE) 2021-12-29 EP disclosed
EP-3927757-A1 NOVEL TWO-COMPONENT OUTER COATING CONTAINING POLYASPARTIC ACID ESTERS Covestro Intellectual Property GmbH & Co. KG (DE) 2021-12-29 EP disclosed
EP-3849962-A1 POLYASPARTIC ACID ESTER COMPOSITIONS AND METHOD FOR PURIFICATION Covestro Deutschland AG (DE) 2021-07-21 EP disclosed
EP-3684834-A1 POLYASPARTIC ACID ESTER COMPOSITIONS WHICH CONTAIN POLYASPARTIC ACID ESTERS WITH PRIMARY AMINO GROUPS AND SMALL AMOUNTS OF FUMARIC ACID DIALKYL ESTERS Covestro Deutschland AG (DE) 2020-07-29 EP disclosed
WO-2019057626-A1 POLYASPARTIC ACID ESTER COMPOSITIONS WHICH CONTAIN POLYASPARTIC ACID ESTERS WITH PRIMARY AMINO GROUPS AND SMALL AMOUNTS OF FUMARIC ACID DIALKYL ESTERS COVESTRO DEUTSCHLAND AG (DE) 2019-03-28 WO disclosed
WO-2019057627-A1 POLYASPARTIC ACID ESTER COMPOSITIONS AND METHOD FOR PURIFICATION COVESTRO DEUTSCHLAND AG (DE) 2019-03-28 WO disclosed
EP-2563840-A1 SEMI-AROMATIC POLYAMIDE DSM IP Assets B.V. (NL) 2013-03-06 EP disclosed
WO-2011135018-A1 SEMI-AROMATIC POLYAMIDE DSM IP ASSETS B.V. (NL) 2011-11-03 WO disclosed
US-20040236021-A1 Powder coatings produced with crosslinkers capable of curing at low temperatures and coated articles produced therefrom BAYER MATERIALSCIENCE LLC 2004-11-25 US disclosed