SCHEMBL822699

SCHEMBL822699

O=S(=O)(c1ccc(-c2ccc(OCCOC3CCCCO3)cc2)cc1)c1ccc(-c2ccc(SCCOC3CCCCO3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 3/20 0.38
PKM P14618 2/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 1/20 0.35
HRH3 Q9Y5N1 5/20 0.34
KCNH2 Q12809 2/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
CHEK1 O14757 1/20 0.33
NR2F2 P24468 1/20 0.33
ADORA3 P0DMS8 1/20 0.31
CXCR4 P61073 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
SCHEMBL822684 1.00 MEN1 (0.47) MEN1KMT2AALDH1A1PKMLMNA
SCHEMBL20924566 0.92 MEN1 (0.41) MEN1KMT2AALDH1A1PKMLMNA
SCHEMBL822693 0.91 MEN1 (0.55) MEN1KMT2AALDH1A1PKMLMNA
SCHEMBL822686 0.87 MEN1 (0.39) MEN1KMT2AALDH1A1PKMLMNA
SCHEMBL822700 0.86 MEN1 (0.50) MEN1KMT2AALDH1A1PKMLMNA
SCHEMBL822704 0.83 MEN1 (0.34) MEN1KMT2AALDH1A1LMNAKDM4C
SCHEMBL811405 0.73 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4CRAB9A
SCHEMBL9785546 0.73 MEN1 (0.45) MEN1KMT2AALDH1A1LMNAKDM4C
SCHEMBL2367702 0.72 MEN1 (0.59) MEN1KMT2AKDM4CRAB9ANPC1
SCHEMBL171304 0.72 MEN1 (0.59) MEN1KMT2ALMNAKDM4CRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2390684-B1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CANON KK (JP) 2019-04-24 EP disclosed
US-8829230-B2 Optical element compound, optical material, and optical element CANON KABUSHIKI KAISHA (JP) 2014-09-09 US disclosed
US-8829230-B2 Optical element compound, optical material, and optical element CANON KABUSHIKI KAISHA (JP) 2014-09-09 US disclosed
US-20140031582-A1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CANON KABUSHIKI KAISHA (JP) 2014-01-30 US disclosed
US-20140031582-A1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CANON KABUSHIKI KAISHA (JP) 2014-01-30 US disclosed
US-8569541-B2 Optical element compound, optical material, and optical element CANON KABUSHIKI KAISHA (JP) 2013-10-29 US disclosed
US-8569541-B2 Optical element compound, optical material, and optical element CANON KABUSHIKI KAISHA (JP) 2013-10-29 US disclosed
EP-2390684-A2 Optical element compound, optical material, and optical element Canon Kabushiki Kaisha (JP) 2011-11-30 EP disclosed
US-20110288330-A1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CANON KABUSHIKI KAISHA (JP) 2011-11-24 US disclosed
US-20110288330-A1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CANON KABUSHIKI KAISHA (JP) 2011-11-24 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 (1 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-20110288330-A1 OPTICAL ELEMENT COMPOUND, OPTICAL MATERIAL, AND OPTICAL ELEMENT CENPE, AXIN2, CCNE2 MEN1 1609/4885KMT2A 1605/4885ALDH1A1 1823/4885

“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.