SCHEMBL5011462

SCHEMBL5011462

O=C(O)Cn1ccn(C(c2ccccc2)c2ccccc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ SLC6A9 P48067 1/20 0.40
▸ PTGS2 P35354 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GLA P06280 1/20 0.36

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
SCHEMBL13994892 0.88 USP2 (0.37) KMT2AAPEX1ALDH1A1LMNASLC6A9
Bromide SCHEMBL5563404 0.76 GAA (0.35) ALDH1A1
SCHEMBL10123555 0.76 ALDH1A1 (0.40) KMT2AAPEX1ALDH1A1MAPTMEN1
SCHEMBL17870725 0.72 GAA (0.47) KMT2AAPEX1MEN1SLC6A9KDM4E
SCHEMBL3590708 0.66 ALDH1A1 (0.43) KMT2AAPEX1ALDH1A1MAPTMEN1
SCHEMBL3581778 0.66 ALDH1A1 (0.43) KMT2AAPEX1ALDH1A1MAPTMEN1
SCHEMBL1280773 0.66 TSHR (0.56) KMT2AAPEX1ALDH1A1MAPTMEN1
SCHEMBL27771722 0.65 PTGDR2 (0.55) KMT2AAPEX1ALDH1A1MAPTCA12
SCHEMBL6198182 0.64 KMT2A (0.42) KMT2AAPEX1ALDH1A1MAPTMEN1
SCHEMBL11538981 0.64 GAA (0.43) KMT2AALDH1A1MAPTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306087-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-11 — — US disclosed
EP-1915355-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2008-04-30 — — EP disclosed
WO-2007018459-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-02-15 — — 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-20080306087-A1 Therapeutic Agents NLN, BDNF, GAP43 KMT2A 3556/4885APEX1 4765/4885ALDH1A1 500/4885

“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.

Send feedback