SCHEMBL2448060

SCHEMBL2448060

Cc1nccn1-c1ccc(Nc2nc3c(c(NCC4CCOCC4)n2)CN(C)CC3)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.40
TNK2 Q07912 6/20 0.40
JAK2 O60674 2/20 0.40
CHEK1 O14757 1/20 0.40
ABL1 P00519 1/20 0.40
LCK P06239 1/20 0.40
ROS1 P08922 1/20 0.40
FGFR1 P11362 1/20 0.40
SRC P12931 1/20 0.40
TYK2 P29597 1/20 0.40
ALK Q9UM73 1/20 0.40
KCNH3 Q9ULD8 1/20 0.39
SYK P43405 3/20 0.38
MET P08581 1/20 0.38
AXL P30530 1/20 0.38
MERTK Q12866 1/20 0.38
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
LRRK2 Q5S007 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
SCHEMBL2447374 0.88 SYK (0.41) TRPV1TNK2JAK2TYK2KCNH3
SCHEMBL2454972 0.88 TNK2 (0.52) TNK2JAK2CHEK1ABL1LCK
SCHEMBL2481502 0.88 TNK2 (0.52) TNK2JAK2CHEK1ABL1LCK
SCHEMBL2481505 0.88 TNK2 (0.52) TNK2JAK2CHEK1ABL1LCK
SCHEMBL2452259 0.87 JAK2 (0.38) TNK2JAK2CHEK1ABL1LCK
SCHEMBL2482618 0.86 KCNH3 (0.39) TRPV1TNK2JAK2CHEK1ABL1
SCHEMBL2843649 0.85 SYK (0.47) TRPV1JAK2SYKMERTK
SCHEMBL2475554 0.81 SYK (0.44) TRPV1JAK2TYK2ALKSYK
SCHEMBL2449765 0.79 SYK (0.39) TRPV1JAK2ABL1FGFR1SRC
SCHEMBL2447413 0.78 PRKCQ (0.45) TRPV1TNK2JAK2CHEK1ABL1

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 13 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 claimed
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
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 TRPV1 3250/4885TNK2 1455/4885JAK2 3639/4885

“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.