SCHEMBL6027342

SCHEMBL6027342

Fc1cccc(OC(F)(F)F)c1CBr

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
KCNN4 O15554 1/20 0.34
CDK2 P24941 1/20 0.34
TRPA1 O75762 1/20 0.33
KCNK3 O14649 3/20 0.33
KCNK9 Q9NPC2 3/20 0.33
KDM4E B2RXH2 2/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
EPHX2 P34913 1/20 0.33
F2R P25116 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
MAPK1 P28482 1/20 0.31

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
SCHEMBL696298 0.83 KCNK3 (0.33) MPLSLC6A2SLC6A4KCNK3KCNK9
SCHEMBL31373396 0.80 GRIA1 (0.40) TAAR1
SCHEMBL18585068 0.80 GRIA1 (0.40) TAAR1
SCHEMBL696401 0.77 L3MBTL1 (0.46) SLC6A2SLC6A4KCNH2KDM4EMAPK1
SCHEMBL29712485 0.77 L3MBTL1 (0.46) SLC6A2SLC6A4KCNH2KDM4EMAPK1
SCHEMBL121801 0.75 TAAR1 (0.43) TRPA1KDM4ETAAR1SMN1; SMN2
SCHEMBL22686218 0.75 MPL (0.37) MPLCYP2D6SLC6A2SLC6A4KCNH2
SCHEMBL18149715 0.74 SLC6A2 (0.46) SLC6A2SLC6A4KCNH2KCNN4KDM4E
SCHEMBL20239470 0.74 L3MBTL1 (0.51) CYP2D6KCNN4KDM4EMAPK1
SCHEMBL29819708 0.74 L3MBTL1 (0.51) CYP2D6KCNN4KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1369490-B1 Method of preparing a composition containing hygromycin A and epi-hygromycin PFIZER PROD INC (US) 2006-02-08 EP disclosed
EP-1369490-A1 Method of preparing a composition containing hygromycin A and epi-hygromycin Pfizer Products Inc. (US) 2003-12-10 EP disclosed
EP-1075483-B1 HYGROMYCIN A DERIVATIVES PFIZER PROD INC (US) 2003-12-03 EP disclosed
US-6313100-B1 ANTIBACTERIAL, ANTIPROTOZOA AGENTS PFIZER INC 2001-11-06 US disclosed
CN-1299365-A Hygromycin A derivatives PFIZER PROD INC (US) 2001-06-13 CN disclosed