SCHEMBL25825583

SCHEMBL25825583

CC(C)c1nc2cc(C(C)(C)C)ccn2n1

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.32
KCNH2 Q12809 1/20 0.31
ADORA3 P0DMS8 2/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
PIK3CD O00329 1/20 0.30
PAK4 O96013 1/20 0.30
JAK1 P23458 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
CSNK1A1 P48729 1/20 0.30
PIK3CG P48736 1/20 0.30
AAK1 Q2M2I8 1/20 0.30
PIP4K2C Q8TBX8 1/20 0.30
CSNK1G1 Q9HCP0 1/20 0.30
NAMPT P43490 1/20 0.30
AHR P35869 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
SCHEMBL24783566 0.78 ALDH1A1 (0.34) PDE10AKCNH2ADORA3ADORA2AADORA1
SCHEMBL798669 0.78 AHR (0.33) NAMPTAHR
SCHEMBL18626423 0.77 HAVCR2 (0.39) PDE10ANAMPTAHR
SCHEMBL9108919 0.77 PIK3CG (0.35) PIK3CDPIK3CAPIK3CGNAMPTAHR
SCHEMBL25097481 0.77 KCNH2 (0.36) PDE10AKCNH2ADORA3ADORA2AADORA1
SCHEMBL26505473 0.77 PIK3CG (0.47) PIK3CDPAK4JAK1PIK3CAPIK3CB
SCHEMBL9109466 0.77 AHR (0.53) NAMPTAHR
SCHEMBL25825585 0.75 NAMPT (0.41) NAMPTAHR
SCHEMBL25097480 0.74 PDE10A (0.39) PDE10AKCNH2ADORA3ADORA2AADORA1
SCHEMBL26505465 0.74 PIK3CG (0.35) PDE10AADORA3ADORA2AADORA1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR PDE10A 529/4885KCNH2 4816/4885ADORA3 1039/4885

“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.