SCHEMBL3558341

SCHEMBL3558341

CCOC(=O)c1cc2oc(C)cc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 3/20 0.52
RAB9A P51151 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HSD17B10 Q99714 1/20 0.52
LMNA P02545 4/20 0.51
NPC1 O15118 2/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
GLA P06280 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
ATM Q13315 1/20 0.51
ALOX15 P16050 1/20 0.50
SMYD3 Q9H7B4 2/20 0.49
HTT P42858 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
MMP13 P45452 7/20 0.48

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
SCHEMBL1233351 0.86 KDM4E (0.51) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL12863897 0.85 SMYD3 (0.45) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1245121 0.85 ALOX15 (0.55) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL6629755 0.85 KDM4E (0.50) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1244245 0.85 ALDH1A1 (0.50) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1242690 0.84 SMYD3 (0.53) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL13175414 0.84 KDM4E (0.49) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL12863849 0.83 SMYD3 (0.44) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1244958 0.81 KDM4E (0.47) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL13175415 0.81 LMNA (0.47) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2022794-B1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME UNIV KEIO (JP) 2017-08-23 EP disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-8193350-B2 Fluorescent compound and labeling agent comprising the same KEIO UNIVERSITY (JP) 2012-06-05 US disclosed
US-7645758-B2 Heterocyclic compounds Janssen Pharmaceutica, N.Y. (BE) 2010-01-12 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same KEIO UNIVERSITY (JP) 2009-07-09 US disclosed
EP-2022794-A1 FLUORESCENT COMPOUND AND LABELING AGENT COMPRISING THE SAME Keio University (JP) 2009-02-11 EP disclosed
US-20070185131-A1 Heterocyclic Compounds JANSSEN PHARMACEUTICA, N.V. 2007-08-09 US disclosed
US-20070185120-A1 Heterocyclic Compounds JANSSEN PHARMACEUTICA, N.V. 2007-08-09 US disclosed
US-7226938-B2 Heterocyclic compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2007-06-05 US disclosed
EP-1543011-B1 THIENOPYRROLYL AND FURANOPYRROLYL COMPOUNDS AND THEIR USE AS HISTAMINE H4 RECEPTOR LIGANDS JANSSEN PHARMACEUTICA NV (BE) 2006-05-03 EP disclosed
EP-1543011-A2 THIENOPYRROLYL AND FURANOPYRROLYL COMPOUNDS AND THEIR USE AS HISTAMINE H4 RECEPTOR LIGANDS JANSSEN PHARMACEUTICA N.V. (BE) 2005-06-22 EP disclosed
WO-2004022537-A2 THIENOPYRROLYL AND FURANOPYRROLYL COMPOUNDS AND THEIR USE AS HISTAMINE H4 RECEPTOR LIGANDS JANSSEN PHARMACEUTICA, N.V. (BE) 2004-03-18 WO disclosed
US-20040048878-A1 Cyclopentathienopyrroles and cyclopentafuranopyrroles for treating disorders and conditions mediated by the histamine H4 receptor, including allergic rhinitis. JANSSEN PHARMACEUTICA, N.V. (BE) 2004-03-11 US disclosed
EP-1056451-B1 BICYCLIC PYRROLE DERIVATIVES AS MCP-1 INHIBITORS ASTRAZENECA UK LTD (GB) 2002-11-13 EP disclosed
US-6479527-B1 Bicyclic pyrrole derivatives as MCP-1 inhibitors ASTRAZENECA UK LIMITED (GB) 2002-11-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090176313-A1 Fluorescent Compound and Labeling Agent Comprising the Same IK, SLC46A1, RB1 KDM4E 3728/4885ALDH1A1 2694/4885HPGD 4229/4885
US-20040048878-A1 Cyclopentathienopyrroles and cyclopentafuranopyrroles for treating disorders and conditions mediated by the histamine H4 receptor, including allergic rhinitis. HRH4, HRH2, HRH1 KDM4E 1848/4885ALDH1A1 3011/4885HPGD 243/4885
US-20070185131-A1 Heterocyclic Compounds HRH4, HRH2, HRH1 KDM4E 2856/4885ALDH1A1 1953/4885HPGD 81/4885
US-20070185120-A1 Heterocyclic Compounds HRH4, HRH2, HRH1 KDM4E 2856/4885ALDH1A1 1953/4885HPGD 81/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.