SCHEMBL2450754

SCHEMBL2450754

CC(C)(C)OC(=O)N1CCC(=O)C(C(=O)Cc2ccccc2F)C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.53
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
P2RX3 P56373 1/20 0.43
BTK Q06187 1/20 0.42
KDM1A O60341 1/20 0.41
KDM1B Q8NB78 1/20 0.41
GRM5 P41594 1/20 0.40
GRM1 Q13255 1/20 0.40
PDK4 Q16654 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
ESR2 Q92731 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38

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
SCHEMBL27842633 0.86 P2RX3 (0.45) GPR119MAPTP2RX3GRM5GRM1
SCHEMBL2451668 0.84 GPR119 (0.50) GPR119SMN1; SMN2P2RX3PDK4KDM4E
SCHEMBL2448797 0.83 SIGMAR1 (0.40) SMN1; SMN2KDM4EALDH1A1
SCHEMBL31287976 0.81 KDM4E (0.43) GPR119MAPTSMN1; SMN2GRM5GRM1
SCHEMBL1474817 0.80 GPR119 (0.56) GPR119MAPTSMN1; SMN2BTKALDH1A1
SCHEMBL2453095 0.79 TP53 (0.47) GPR119SMN1; SMN2KDM1AKDM1BPDK4
SCHEMBL1475476 0.79 GPR119 (0.63) GPR119MAPTSMN1; SMN2KDM1AKDM1B
SCHEMBL18815293 0.78 MAPT (0.42) GPR119MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL17377101 0.77 KDM4E (0.48) GPR119PDK4KDM4EJAK2JAK1
SCHEMBL2846672 0.76 P2RX3 (0.46) GPR119MAPTP2RX3

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 10 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
CN-102272133-A Modulators of amyloid beta 2011-12-07 CN 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 GPR119 1378/4885MAPT 10/4885SMN1; SMN2 318/4885

“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.