SCHEMBL2979437

SCHEMBL2979437

CC(CO)n1cnc(N)c1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CPA1 P15085 1/20 0.35
CPB2 Q96IY4 1/20 0.35
ADA P00813 3/20 0.33
KDM5A P29375 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
KDM5B Q9UGL1 1/20 0.31
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
ADORA1 P30542 1/20 0.30

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
SCHEMBL2971484 0.80 CPB2 (0.36) CPA1CPB2ADAKDM5AKDM4C
SCHEMBL14857100 0.78 KDM5A (0.32) CPA1CPB2ADAKDM5AKDM4C
SCHEMBL14857102 0.78 KDM5A (0.32) CPA1CPB2ADAKDM5AKDM4C
Hydrochloric Acid SCHEMBL22833790 0.77 CPA1 (0.40) CPA1CPB2KDM5AADORA2AADORA2B
SCHEMBL1797358 0.77 MAPT (0.38) CPA1CPB2ADAKDM5AKDM4C
SCHEMBL19789308 0.76 KDM5A (0.32) ADAKDM5AKDM4CKDM5B
SCHEMBL1796174 0.73 PSEN1 (0.32) CPA1CPB2ADORA2AADORA2BADORA1
SCHEMBL29663447 0.72 ADA (0.47) ADAKDM5AKDM4CKDM5B
SCHEMBL18040235 0.72 ADA (0.47) ADAKDM5AKDM4CKDM5B
SCHEMBL29663112 0.72 ADA (0.47) ADAKDM5AKDM4CKDM5B

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-7781435-B2 Imidazole compounds for the treatment of neurological disorders PFIZER INC (US) 2010-08-24 US disclosed
US-20100184737-A1 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PFIZER INC (US) 2010-07-22 US disclosed
EP-1940802-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Pfizer Products Inc. (US) 2008-07-09 EP disclosed
WO-2007034326-A2 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS PFIZER PRODUCTS INC. (US) 2007-03-29 WO disclosed
US-20070066613-A1 Imidazole compounds for the treatment of neurological disorders PFIZER INC 2007-03-22 US 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 (2 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-20070066613-A1 Imidazole compounds for the treatment of neurological disorders APP, PSEN1, BACE1 CPA1 2867/4885CPB2 3183/4885ADA 2029/4885
US-20100184737-A1 IMIDAZOLE COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS APP, PSEN1, BACE1 CPA1 2867/4885CPB2 3183/4885ADA 2029/4885

“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.