SCHEMBL8905433

SCHEMBL8905433

CC(C)(C)OC(=O)N1CCc2nc(Nc3ccc(-c4cnco4)cc3)nc(NC[C@@H]3CCCO3)c2C1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTOR P42345 3/20 0.43
GPR119 Q8TDV5 7/20 0.42
MAPT P10636 1/20 0.42
BRD4 O60885 1/20 0.42
CREBBP Q92793 1/20 0.42
TNK2 Q07912 7/20 0.41
SYK P43405 1/20 0.40
CHEK1 O14757 1/20 0.40
JAK2 O60674 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

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
SCHEMBL8905368 1.00 MTOR (0.43) MTORGPR119MAPTBRD4CREBBP
SCHEMBL2451706 0.90 CREBBP (0.53) MAPTBRD4CREBBPTNK2SYK
SCHEMBL2847162 0.90 CREBBP (0.53) MAPTBRD4CREBBPTNK2SYK
SCHEMBL8906858 0.90 MTOR (0.45) MTORGPR119MAPTBRD4CREBBP
SCHEMBL2447109 0.89 TNK2 (0.46) MAPTBRD4CREBBPTNK2SYK
SCHEMBL8905475 0.85 GPR119 (0.44) MTORGPR119MAPTBRD4CREBBP
SCHEMBL2449021 0.85 TNK2 (0.49) MAPTTNK2CHEK1JAK2ABL1
SCHEMBL2449020 0.85 TNK2 (0.49) MAPTTNK2CHEK1JAK2ABL1
SCHEMBL2848425 0.85 TNK2 (0.49) MAPTTNK2CHEK1JAK2ABL1
SCHEMBL2447065 0.84 MAPT (0.45) MTORGPR119MAPTBRD4CREBBP

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 5 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-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 MTOR 764/4885GPR119 1378/4885MAPT 10/4885

“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.