SCHEMBL2886639

SCHEMBL2886639

CCCCN(C)NCCC

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.36
TSHR P16473 3/20 0.33
ALDH1A1 P00352 2/20 0.33
EPHX1 P07099 1/20 0.31
ALDH2 P05091 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL2852729 0.92 DNM1 (0.46) DNM1TSHRALDH1A1EPHX1CA12
SCHEMBL1492466 0.90 DNM1 (0.50) DNM1TSHRALDH1A1EPHX1
SCHEMBL2883356 0.90 TSHR (0.38) DNM1TSHRALDH1A1EPHX1ALDH2
SCHEMBL10719321 0.87 TSHR (0.43) DNM1TSHRALDH1A1EPHX1
SCHEMBL2887340 0.83
SCHEMBL9326337 0.83 TDP1 (0.40) DNM1TSHRALDH1A1EPHX1
SCHEMBL5699101 0.83 ALDH1A1 (0.38) DNM1TSHRALDH1A1ALDH2CA12
SCHEMBL21016410 0.82 DNM1 (0.46) DNM1TSHRALDH1A1EPHX1
SCHEMBL2885824 0.81
SCHEMBL17073505 0.80 DNM1 (0.50) DNM1TSHRALDH1A1EPHX1CA12

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
EP-2545057-B1 PYRIMIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF RESPIRATORY DISEASES SUCH AS COPD CHIESI FARM SPA (IT) 2017-06-07 EP disclosed
US-7670753-B2 Lithographic printing plate precursor EASTMAN KODAK COMPANY (US) 2010-03-02 US disclosed
US-20080261146-A1 Lithographic Printing Plate Precursor EASTMAN KODAK COMPANY 2008-10-23 US disclosed
EP-1782127-B1 LITHOGRAPHIC PRINTING PLATE PRECURSOR EASTMAN KODAK CO (US) 2008-04-02 EP disclosed
EP-1782127-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR EASTMAN KODAK COMPANY (US) 2007-05-09 EP disclosed
WO-2006023667-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR EASTMAN KODAK COMPANY (US) 2006-03-02 WO disclosed