SCHEMBL6468946

SCHEMBL6468946

CC(C)(C)CCNCc1cnc(N)cn1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
F2 P00734 3/20 0.35
NUDT1 P36639 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
OPRM1 P35372 2/20 0.30
OPRK1 P41145 2/20 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
SCHEMBL6468944 0.78 SIRT6 (0.44) KMT2AOPRM1OPRK1
SCHEMBL5132531 0.78 MEN1 (0.42) MEN1KMT2AF2
SCHEMBL6468988 0.78 TLR7 (0.44) MEN1KMT2AF2
SCHEMBL13412486 0.77 NUDT1 (0.43) MEN1KMT2ANUDT1KDM4EHSD17B10
SCHEMBL6470756 0.75 MEN1 (0.40) MEN1KMT2AF2
SCHEMBL6468950 0.74 MEN1 (0.44) MEN1KMT2AF2OPRM1OPRK1
SCHEMBL807843 0.72 MEN1 (0.49) MEN1KMT2AF2
SCHEMBL11523536 0.72 MEN1 (0.38) MEN1KMT2ANUDT1KDM4EHSD17B10
SCHEMBL6193695 0.69 POLB (0.39) NUDT1HSD17B10
SCHEMBL17282054 0.68 CHRM2 (0.62) MEN1KMT2AKDM4ESIRT2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 US claimed
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders APP, BACE1, SNCA MEN1 978/4885KMT2A 2085/4885F2 1581/4885

“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.