SCHEMBL2029699

SCHEMBL2029699

O=C1c2c(Cl)cc(-c3cnn(Cc4cccnc4)c3)cc2CN1Cc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 4/20 0.42
KCNH2 Q12809 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
PTGER2 P43116 1/20 0.39
USP2 O75604 2/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CREBBP Q92793 1/20 0.38
POLB P06746 1/20 0.38
ESR2 Q92731 1/20 0.38
DHPS P49366 1/20 0.38
PKM P14618 1/20 0.38
NAMPT P43490 1/20 0.38
HDAC4 P56524 1/20 0.38

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
SCHEMBL12641817 0.94 L3MBTL1 (0.53) L3MBTL1ALDH1A1MEN1KMT2AUSP2
SCHEMBL2029579 0.91 CYP3A4 (0.46) L3MBTL1KCNH2CYP3A4CYP2C9CREBBP
SCHEMBL2024184 0.88 ABL1 (0.49) L3MBTL1ALDH1A1MEN1KMT2AUSP2
SCHEMBL12442783 0.87 L3MBTL1 (0.46) L3MBTL1CYP3A4CYP2C9CREBBPNAMPT
SCHEMBL12441929 0.86 L3MBTL1 (0.47) L3MBTL1ALDH1A1CREBBPDHPSNAMPT
SCHEMBL2022601 0.85 DHPS (0.47) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL2025435 0.84 CREBBP (0.46) L3MBTL1KCNH2CYP3A4CYP2C9CREBBP
SCHEMBL12580806 0.84 L3MBTL1 (0.45) L3MBTL1ALDH1A1CREBBPDHPSNAMPT
SCHEMBL8271338 0.80 CREBBP (0.48) L3MBTL1CREBBPPOLBNAMPTKDM5B
SCHEMBL8271133 0.80 DHPS (0.56) L3MBTL1ALDH1A1CYP3A4CYP2C9DHPS

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
US-20090275578-A1 Isoindolone compounds and their use as metabotropic glutamate receptor potentiators ASTRAZENECA AB (SE) 2009-11-05 US claimed
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

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 L3MBTL1 4816/4885ALDH1A1 1582/4885KCNH2 649/4885

“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.