SCHEMBL10068624

SCHEMBL10068624

CCN1/C(=C\C=C\c2oc3ccccc3[n+]2CC)Oc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 12/20 0.46
KMT2A Q03164 12/20 0.46
HTT P42858 8/20 0.46
KDM4E B2RXH2 6/20 0.46
MAPT P10636 6/20 0.46
RAB9A P51151 5/20 0.46
TDP1 Q9NUW8 4/20 0.46
NPC1 O15118 4/20 0.46
THRB P10828 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
USP2 O75604 2/20 0.46
POLB P06746 2/20 0.46
CTNNB1 P35222 2/20 0.46
ABCB1 P08183 1/20 0.46
APEX1 P27695 1/20 0.46
ALDH1A1 P00352 5/20 0.46
LMNA P02545 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46

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
SCHEMBL12364496 1.00 MEN1 (0.46) MEN1KMT2AHTTKDM4EMAPT
SCHEMBL30686974 1.00 MEN1 (0.46) MEN1KMT2AHTTKDM4EMAPT
SCHEMBL29358704 1.00 MEN1 (0.46) MEN1KMT2AHTTKDM4EMAPT
SCHEMBL10035959 1.00 MEN1 (0.46) MEN1KMT2AHTTKDM4EMAPT
SCHEMBL2410627 1.00 MEN1 (0.46) MEN1KMT2AHTTKDM4EMAPT
Iodide SCHEMBL457968 0.99 MEN1 (0.47) MEN1KMT2AHTTKDM4EMAPT
Iodide SCHEMBL32672581 0.99 MEN1 (0.47) MEN1KMT2AHTTKDM4EMAPT
Iodide SCHEMBL2464686 0.99 MEN1 (0.47) MEN1KMT2AHTTKDM4EMAPT
Iodide SCHEMBL457967 0.99 MEN1 (0.47) MEN1KMT2AHTTKDM4EMAPT
Iodide SCHEMBL29364175 0.99 MEN1 (0.47) MEN1KMT2AHTTKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167303-A1 COLOR MATCHED AND BRIGHT FLUORESCENT MATERIALS COMPOSED OF SMALL-MOLECULE IONIC LATTICES UNIVERSITY OF COPENHAGEN (DK) 2023-06-01 US disclosed
US-20230167303-A1 COLOR MATCHED AND BRIGHT FLUORESCENT MATERIALS COMPOSED OF SMALL-MOLECULE IONIC LATTICES UNIVERSITY OF COPENHAGEN (DK) 2023-06-01 US disclosed
US-20200407628-A1 COLOR MATCHED AND BRIGHT FLUORESCENT MATERIALS COMPOSED OF SMALL-MOLECULE IONIC LATTICES UNIVERSITY OF COPENHAGEN (DK) 2020-12-31 US disclosed
US-10041937-B2 Macrophage identification agent, and identification method, sorting method, evaluation method, screening method and kit using the macrophage identifier agent CANON KABUSHIKI KAISHA (JP) 2018-08-07 US disclosed
US-20170340622-A1 METHOD OF DETECTING CANCER STEM CELL, METHOD OF SCREENING CANCER STEM CELL, AND METHOD OF INHIBITING CANCER STEM CELL CANON KK (JP) 2017-11-30 US disclosed
US-20170340622-A1 METHOD OF DETECTING CANCER STEM CELL, METHOD OF SCREENING CANCER STEM CELL, AND METHOD OF INHIBITING CANCER STEM CELL CANON KK (JP) 2017-11-30 US disclosed
EP-2656410-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2017-07-05 EP disclosed
US-20160018389-A1 MACROPHAGE IDENTIFICATION AGENT, AND IDENTIFICATION METHOD, SORTING METHOD, EVALUATION METHOD, SCREENING METHOD AND KIT USING THE MACROPHAGE IDENTIFIER AGENT CANON KABUSHIKI KAISHA (JP) 2016-01-21 US disclosed
US-20150182518-A1 CANCER CELL INHIBITORY DRUG AND CANCER STEM-CELL DETECTION PROBE CANON KABUSHIKI KAISHA (JP) 2015-07-02 US disclosed
US-20150182518-A1 CANCER CELL INHIBITORY DRUG AND CANCER STEM-CELL DETECTION PROBE CANON KABUSHIKI KAISHA (JP) 2015-07-02 US disclosed
US-20130296288-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2013-11-07 US disclosed
US-20130219529-A1 PROBE FOR A HAIR CELL, AND LABELLING METHOD FOR A HAIR CELL USING THE PROBE FOR A HAIR CELL CANON KABUSHIKI KAISHA (JP) 2013-08-22 US disclosed
US-8460639-B2 Probe for a hair cell, and labelling method for a hair cell using the probe for a hair cell CANON KABUSHIKI KAISHA (JP) 2013-06-11 US disclosed
WO-2012084115-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2012-06-28 WO disclosed
US-20100166663-A1 PROBE FOR A HAIR CELL, AND LABELLING METHOD FOR A HAIR CELL USING THE PROBE FOR A HAIR CELL CANON KABUSHIKI KAISHA (JP) 2010-07-01 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 (6 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-20170340622-A1 METHOD OF DETECTING CANCER STEM CELL, METHOD OF SCREENING CANCER STEM CELL, AND METHOD OF INHIBITING CANCER STEM CELL MKI67, KIT, ALDH1A1 MEN1 2213/4885KMT2A 2616/4885HTT 4650/4885
US-10041937-B2 Macrophage identification agent, and identification method, sorting method, evaluation method, screening method and kit using the macrophage identifier agent CD68, MSR1, MYADM MEN1 1787/4885KMT2A 578/4885HTT 4857/4885
US-20150182518-A1 CANCER CELL INHIBITORY DRUG AND CANCER STEM-CELL DETECTION PROBE MKI67, ABCB1, CD44 MEN1 2178/4885KMT2A 2210/4885HTT 4278/4885
US-20160018389-A1 MACROPHAGE IDENTIFICATION AGENT, AND IDENTIFICATION METHOD, SORTING METHOD, EVALUATION METHOD, SCREENING METHOD AND KIT USING THE MACROPHAGE IDENTIFIER AGENT CD68, MSR1, MYADM MEN1 1787/4885KMT2A 578/4885HTT 4857/4885
US-20100166663-A1 PROBE FOR A HAIR CELL, AND LABELLING METHOD FOR A HAIR CELL USING THE PROBE FOR A HAIR CELL ALPG, MKI67, KRT18 MEN1 2225/4885KMT2A 3444/4885HTT 3311/4885
US-20130296288-A1 ORGANIC ELECTROLUMINESCENT DEVICE SLC26A3, SLCO4C1, ICMT MEN1 2141/4885KMT2A 2852/4885HTT 1495/4885

“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.