SCHEMBL2883930

SCHEMBL2883930

CCCCNN(C)CCC

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
DNM1 Q05193 5/20 0.36
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH7 P40394 1/20 0.33
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ALDH1A1 P00352 1/20 0.33
EPHX1 P07099 3/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
ALOX15 P16050 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
SCHEMBL2883356 0.90 TSHR (0.38) TSHRDNM1CA1CA2ADH1B
SCHEMBL17073505 0.85 DNM1 (0.50) TSHRDNM1CA1CA2CA12
SCHEMBL2887340 0.83
SCHEMBL13087202 0.83 TDP1 (0.45) TSHRDNM1CA1CA2CA12
SCHEMBL10719321 0.82 TSHR (0.43) TSHRDNM1ADH1BADH1CADH1A
SCHEMBL21016410 0.82 DNM1 (0.46) TSHRDNM1ADH1BADH1CADH1A
SCHEMBL2886173 0.81
SCHEMBL27890407 0.80 DNM1 (0.50) TSHRDNM1ADH1BADH1CADH1A
SCHEMBL2886639 0.79 DNM1 (0.36) TSHRDNM1CA1CA12ALDH1A1
SCHEMBL2852729 0.77 DNM1 (0.46) TSHRDNM1CA1CA2ADH1C

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
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
US-4101462-A ALKYLENEDIAMINE-SUBSTITUTED POLYOXYALKYLENE TEXACO DEVELOPMENT CORP. (US) 1978-07-18 US disclosed