SCHEMBL2019162

SCHEMBL2019162

O=C1c2cc(Cl)ccc2CN1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.56
HDAC4 P56524 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
ALDH1A1 P00352 2/20 0.51
ALDH2 P05091 2/20 0.51
ALDH3A1 P30838 2/20 0.51
MAPK1 P28482 1/20 0.47
NR3C1 P04150 1/20 0.46
DHPS P49366 1/20 0.46
PARP1 P09874 1/20 0.46
ADAM17 P78536 2/20 0.46
ADAM10 O14672 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP14 P50281 1/20 0.46
ACHE P22303 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC7 Q8WUI4 1/20 0.44
CYP3A4 P08684 1/20 0.44

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
SCHEMBL2023150 0.88 GRM5 (0.50) HDAC1HDAC4HDAC6ALDH1A1ALDH2
SCHEMBL2023743 0.84 HDAC1 (0.55) HDAC1HDAC4HDAC6DHPSPARP1
SCHEMBL31391661 0.84 KDM4E (0.55) HDAC1HDAC4HDAC6ALDH1A1NR3C1
SCHEMBL20028546 0.84 HDAC1 (0.58) HDAC1HDAC4HDAC6ALDH1A1ALDH2
SCHEMBL15120603 0.84 HDAC1 (0.55) HDAC1HDAC4HDAC6NR3C1DHPS
SCHEMBL16850291 0.84 HDAC1 (0.58) HDAC1HDAC4HDAC6DHPSPARP1
SCHEMBL29010959 0.84 KDM4E (0.55) HDAC1HDAC4HDAC6ALDH1A1NR3C1
SCHEMBL2029640 0.82 MEN1 (0.64) HDAC1ALDH1A1ALDH3A1MAPK1ACHE
SCHEMBL1466305 0.82 KMT2A (0.60) HDAC1HDAC4HDAC6ALDH1A1DHPS
SCHEMBL29630944 0.82 KMT2A (0.60) HDAC1HDAC4HDAC6ALDH1A1DHPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2357169-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators AstraZeneca AB (SE) 2011-08-17 EP disclosed
EP-2357169-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators AstraZeneca AB (SE) 2011-08-17 EP disclosed
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-7968570-B2 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2011-06-28 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US disclosed
EP-1778634-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS AstraZeneca AB (SE) 2007-05-02 EP disclosed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO disclosed
WO-2006020879-A1 ISOINDOLONE COMPOUNDS AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR POTENTIATORS ASTRAZENECA AB (SE) 2006-02-23 WO 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-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators GRM1, GRIN1, GRM3 HDAC1 2500/4885HDAC4 3609/4885HDAC6 3198/4885

“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.