SCHEMBL14959583

SCHEMBL14959583

COc1cccc(Oc2ccc(I)cc2F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
APP P05067 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 2/20 0.41
MAPK14 Q16539 1/20 0.40
MAOB P27338 2/20 0.40
ACHE P22303 2/20 0.39
BCHE P06276 1/20 0.39
FFAR1 O14842 1/20 0.38
NFE2L2 Q16236 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 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
SCHEMBL328387 0.83 MAPK14 (0.54) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL779089 0.82 ACHE (0.53) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL15596867 0.81 MAP2K1 (0.48) L3MBTL1NPSR1LMNATSHR
SCHEMBL15596859 0.80 SMN1; SMN2 (0.46) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL11990101 0.78 MAOB (0.48) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL11989286 0.78 MAPT (0.56) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL14471077 0.78 L3MBTL1 (0.46) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL4016806 0.77 TTR (0.56) MAPTL3MBTL1NPSR1KDM4EPOLB
SCHEMBL425685 0.77 RAB9A (0.50) SMN1; SMN2LMNAACHEBCHEMEN1
SCHEMBL27956884 0.76 FFAR1 (0.47) MAPTL3MBTL1NPSR1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014028334-A1 SELECTIVE MMP INHIBITORS SYMPHONY EVOLUTION, INC. (US) 2014-02-20 WO disclosed
EP-1511488-B1 HUMAN ADAM-10 INHIBITORS SYMPHONY EVOLUTION INC (US) 2013-05-22 EP disclosed