SCHEMBL5213544

SCHEMBL5213544

CC(C)CNC(C)c1cnc(C(N)=O)o1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
FYN P06241 1/20 0.33
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TTK P33981 1/20 0.32
PKM P14618 1/20 0.31
JAK2 O60674 2/20 0.31
JAK1 P23458 1/20 0.31
JAK3 P52333 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
APAF1 O14727 1/20 0.30
SYK P43405 2/20 0.30
KDM6B O15054 1/20 0.30
KDM4C Q9H3R0 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
SCHEMBL5212526 0.85 JAK2 (0.33) POLBL3MBTL1JAK2JAK1JAK3
SCHEMBL5210975 0.81 ACACB (0.32)
SCHEMBL5215225 0.80 PSEN1 (0.33) JAK2JAK1JAK3
SCHEMBL279724 0.77 KDM4E (0.34) ALDH1A1POLBL3MBTL1
SCHEMBL5219697 0.76 PSEN1 (0.56)
SCHEMBL5213549 0.76 AKT1 (0.30)
SCHEMBL5211473 0.75 KDM4E (0.33) ALDH1A1POLBL3MBTL1
SCHEMBL26687319 0.68 NNMT (0.44) HCAR3ALDH1A1L3MBTL1
SCHEMBL5245429 0.67 POLB (0.37) ALDH1A1POLBL3MBTL1
SCHEMBL279423 0.65

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
EP-1653952-A4 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2007-04-04 EP disclosed
US-7112599-B2 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2006-09-26 US disclosed
EP-1653952-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-10 EP disclosed
WO-2005016267-A2 OXAZOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS INC. (US) 2005-02-24 WO disclosed
US-20050032859-A1 Oxazole compounds for the treatment of neurodegenerative disorders PFIZER INC. (US) 2005-02-10 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 (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-20050032859-A1 Oxazole compounds for the treatment of neurodegenerative disorders APP, OXA1L, BACE1 HCAR3 201/4885HCAR2 1065/4885FYN 231/4885

“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.