SCHEMBL1336734

SCHEMBL1336734

C=C(C)C(=O)N(CC)c1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.56
ALDH1A1 P00352 7/20 0.51
KMT2A Q03164 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
TSHR P16473 4/20 0.49
KDM4E B2RXH2 3/20 0.49
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MMP9 P14780 1/20 0.45
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
GAA P10253 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
GLA P06280 1/20 0.38

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
SCHEMBL3255855 0.84 SIGMAR1 (0.62) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL28447545 0.84 MMP9 (0.45) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL2815728 0.81 MMP9 (0.45) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL1567112 0.81 SIGMAR1 (0.62) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL3807502 0.81 SIGMAR1 (0.62) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL31425728 0.80 SIGMAR1 (0.59) SIGMAR1TSHRMMP9GAA
SCHEMBL4079681 0.80 SIGMAR1 (0.59) SIGMAR1TSHRMMP9GAA
SCHEMBL27515197 0.80 SIGMAR1 (0.62) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL9547520 0.78 SIGMAR1 (0.59) SIGMAR1ALDH1A1KMT2AL3MBTL1TSHR
SCHEMBL28995175 0.78 ESR1 (0.41) ALDH1A1KMT2AL3MBTL1TSHRLMNA

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
US-8632896-B2 Radiation-curable vinyl chloride copolymer, radiation-curable composition, and magnetic recording medium FUJIFILM CORPORATION (JP) 2014-01-21 US disclosed
US-8617728-B2 Magnetic tape and method of manufacturing the same FUJIFILM CORPORATION (JP) 2013-12-31 US disclosed
US-8603652-B2 Magnetic recording medium FUJIFILM CORPORATION (JP) 2013-12-10 US disclosed
US-20110274947-A1 MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-11-10 US disclosed
US-20110229740-A1 MAGNETIC TAPE AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2011-09-22 US disclosed
US-20110229741-A1 MAGNETIC RECORDING MEDIUM AND METHOD OF MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2011-09-22 US disclosed
US-20110111258-A1 RADIATION-CURABLE VINYL CHLORIDE COPOLYMER, RADIATION-CURABLE COMPOSITION, AND MAGNETIC RECORDING MEDIUM FUJIFILM CORPORATION (JP) 2011-05-12 US disclosed