SCHEMBL2844684

SCHEMBL2844684

Cc1nccn1-c1ccc(Nc2nc3c(c(C(C)c4ccccc4)n2)CN(C(=O)OC(C)(C)C)CC3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
CCND3 P30281 2/20 0.39
CCNA2 P20248 2/20 0.39
CDK2 P24941 2/20 0.39
CDK9 P50750 2/20 0.39
CCNK O75909 1/20 0.39
CDK6 Q00534 1/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
PDE10A Q9Y233 1/20 0.38
C5AR1 P21730 6/20 0.38
TRPV1 Q8NER1 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
PORCN Q9H237 1/20 0.36
MTOR P42345 1/20 0.35
MKNK1 Q9BUB5 2/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND2 P30279 1/20 0.35

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
SCHEMBL2476632 0.91 CYP3A4 (0.37) MAPTPDE10ACYP3A4CYP2D6PORCN
SCHEMBL2842254 0.86 MAPT (0.51) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL2839484 0.85 MAPT (0.46) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL2452081 0.84 ROCK2 (0.38) TRPV1CYP3A4CYP2D6PORCNCDK4
SCHEMBL2449443 0.82 MAPT (0.46) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL2450286 0.81 MAPT (0.43) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL8905497 0.81 MAPT (0.46) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL2841839 0.80 PDE10A (0.42) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL8904410 0.80 MAPT (0.47) MAPTCCND3CCNA2CDK2CDK9
SCHEMBL2537540 0.80 TRPV1 (0.46) MAPTCCND3CCNA2CDK2CDK9

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 7 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
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

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 MAPT 10/4885CCND3 1044/4885CCNA2 2680/4885

“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.