SCHEMBL2448247

SCHEMBL2448247

CN(c1nc(Nc2ccc(-c3cnco3)cc2)nc2c1CN(CCO)CC2)[C@H]1CCCO1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.37
CREBBP Q92793 1/20 0.37
TRPV1 Q8NER1 1/20 0.35
SYK P43405 2/20 0.34
IMPDH2 P12268 6/20 0.33
CDK4 P11802 1/20 0.33
FLT3 P36888 1/20 0.33
ROCK2 O75116 2/20 0.33
JAK3 P52333 1/20 0.33
PRKCQ Q04759 1/20 0.32
WNT1 P04628 2/20 0.32
GSK3B P49841 2/20 0.32
DYRK1A Q13627 2/20 0.32
KCNH2 Q12809 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
PRLHR P49683 1/20 0.31

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
SCHEMBL2450329 0.92 BRD4 (0.32) BRD4CREBBPTRPV1SYK
SCHEMBL2447187 0.90 BRD4 (0.37) BRD4CREBBPTRPV1SYKIMPDH2
SCHEMBL2451710 0.89 BRD4 (0.35) BRD4CREBBPTRPV1SYKIMPDH2
SCHEMBL2447102 0.87 CREBBP (0.44) BRD4CREBBPTRPV1SYKROCK2
SCHEMBL2847158 0.86 CREBBP (0.51) BRD4CREBBPSYKWNT1GSK3B
SCHEMBL2444124 0.85 BRD4 (0.35) BRD4CREBBPTRPV1SYKIMPDH2
SCHEMBL3126963 0.81 PRKCQ (0.36) BRD4CREBBPTRPV1SYKFLT3
SCHEMBL2448242 0.81 TNK2 (0.43) SYK
SCHEMBL2448252 0.81 TNK2 (0.43) SYK
SCHEMBL2450333 0.81 TNK2 (0.38) BRD4CREBBPSYKPRKCQ

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
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP claimed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US claimed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 WO claimed
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
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 BRD4 1537/4885CREBBP 646/4885TRPV1 3250/4885

“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.