SCHEMBL2446668

SCHEMBL2446668

O=C1CCOCC1C(=O)CCN1CCCC1=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.37
PKM P14618 1/20 0.37
AAK1 Q2M2I8 1/20 0.36
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL5773846 0.73 TLR4 (0.32) LMNA
SCHEMBL3988151 0.72 TSHR (0.46) KMT2ATSHRALDH1A1MEN1PKM
SCHEMBL443220 0.69 TSHR (0.53) KMT2ATSHRALDH1A1MEN1PKM
SCHEMBL2450408 0.69 SMN1; SMN2 (0.36) KMT2ATSHRALDH1A1MEN1KDM4E
SCHEMBL2633812 0.68 TSHR (0.67) KMT2ATSHRMEN1PKMLMNA
SCHEMBL2449756 0.68 TSHR (0.52) KMT2ATSHRALDH1A1MEN1PKM
SCHEMBL13804326 0.68 KMT2A (0.54) KMT2ATSHRMEN1PKMLMNA
SCHEMBL6956193 0.68 TSHR (0.52) KMT2ATSHRALDH1A1MEN1PKM
SCHEMBL2449673 0.68 TLR4 (0.31)
SCHEMBL2939735 0.66 KMT2A (0.49) KMT2ATSHRMEN1PKMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 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-20100130495-A1 COMPOUNDS 563 BACE1, PSEN1, PSEN2 KMT2A 3537/4885TSHR 4650/4885ALDH1A1 4124/4885

“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.