SCHEMBL2450286

SCHEMBL2450286

Cc1nccn1-c1ccc(Nc2nc3c(c(Cc4ccccc4F)n2)CN(C(=O)OC(C)(C)C)CC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
P2RX3 P56373 1/20 0.39
PDE10A Q9Y233 1/20 0.38
C5AR1 P21730 5/20 0.38
CCNA2 P20248 2/20 0.37
CDK2 P24941 2/20 0.37
CDK9 P50750 2/20 0.37
CCNK O75909 1/20 0.37
CCND3 P30281 1/20 0.37
CDK6 Q00534 1/20 0.37
NR3C2 P08235 1/20 0.37
CCNT1 O60563 1/20 0.36
CCNA1 P78396 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
JAK2 O60674 4/20 0.36
JAK3 P52333 4/20 0.36
PTK2 Q05397 3/20 0.36
MTOR P42345 1/20 0.35
EGFR P00533 1/20 0.35
CYP3A4 P08684 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
SCHEMBL2839484 0.90 MAPT (0.46) MAPTP2RX3PDE10AC5AR1CCNA2
SCHEMBL2446860 0.90 CREBBP (0.38) NR3C2PTK2CYP3A4CYP2D6PORCN
SCHEMBL2448106 0.90 NR3C2 (0.38) PDE10ANR3C2PTK2CYP3A4CYP2D6
SCHEMBL8905497 0.87 MAPT (0.46) MAPTPDE10AC5AR1CCNA2CDK2
SCHEMBL2842254 0.85 MAPT (0.51) MAPTPDE10AC5AR1CCNA2CDK2
SCHEMBL2448042 0.84 ROCK2 (0.38) MAPTNR3C2TRPV1JAK2JAK3
SCHEMBL8905655 0.84 MAPT (0.49) MAPTP2RX3PDE10AC5AR1CCNA2
SCHEMBL8905533 0.84 MAPT (0.44) MAPTPDE10AC5AR1CCNA2CDK2
SCHEMBL8904410 0.83 MAPT (0.47) MAPTPDE10AC5AR1CCNA2CDK2
SCHEMBL2477084 0.82 PDCD1 (0.38) MAPTNR3C2TRPV1JAK2EGFR

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 MAPT 10/4885P2RX3 2295/4885PDE10A 920/4885

“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.