SCHEMBL7212405

SCHEMBL7212405

Clc1cccc(Oc2cccc3cccnc23)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
MAPT P10636 6/20 0.51
RAB9A P51151 2/20 0.51
LMNA P02545 6/20 0.50
HPGD P15428 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HTT P42858 3/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.49
GAA P10253 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
POLB P06746 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
RHEB Q15382 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPK1 P28482 1/20 0.45

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
SCHEMBL7212478 0.89 KDM4E (0.55) KDM4EMAPTRAB9ALMNAHPGD
SCHEMBL6026021 0.82 MEN1 (0.49) KDM4EMAPTRAB9ALMNAHPGD
SCHEMBL11543338 0.82 RHEB (0.49) LMNAMEN1KMT2ARHEBCYP1A2
SCHEMBL546185 0.82 RAB9A (0.68) KDM4EMAPTRAB9ALMNAALDH1A1
SCHEMBL7208902 0.81 KDM4E (0.54) KDM4EMAPTRAB9ALMNAHPGD
SCHEMBL9446981 0.81 KDM4E (0.54) KDM4EMAPTRAB9ALMNAHPGD
Hydrochloric Acid SCHEMBL9052059 0.80 RAB9A (0.66) KDM4EMAPTRAB9ALMNAALDH1A1
SCHEMBL366672 0.80 KDM4E (0.53) KDM4EMAPTRAB9ALMNAHPGD
SCHEMBL28792218 0.80 KDM4E (0.49) KDM4EMAPTRAB9ALMNAHPGD
SCHEMBL4386263 0.79 KDM4E (0.72) KDM4EMAPTRAB9ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077984-B1 2\"-DEOXY HYGROMYCIN DERIVATIVES PFIZER PROD INC (US) 2003-06-18 EP claimed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 US claimed
EP-1077984-B1 2\"-DEOXY HYGROMYCIN DERIVATIVES PFIZER PROD INC (US) 2003-06-18 EP disclosed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 US disclosed