SCHEMBL26597002

SCHEMBL26597002

CC(C)(C)n1ncc2ccc(N)nc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.34
CYP1A2 P05177 1/20 0.34
SRC P12931 5/20 0.33
NOS2 P35228 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
PIM1 P11309 1/20 0.32
BACE1 P56817 3/20 0.32
NCK1 P16333 1/20 0.32
NCF1 P14598 1/20 0.31
PAK4 O96013 1/20 0.31
ABL1 P00519 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31
PRKDC P78527 1/20 0.31
RIPK2 O43353 1/20 0.31
PRKD3 O94806 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL26607527 0.83 CDK4 (0.31)
SCHEMBL26622927 0.80 MCHR1 (0.31)
SCHEMBL26607526 0.78 MCHR1 (0.30)
SCHEMBL23346697 0.75 PI4KA (0.40) NOS2NOS3NOS1PIM1BACE1
SCHEMBL30168568 0.75 PI4KA (0.40) NOS2NOS3NOS1PIM1BACE1
SCHEMBL12775617 0.70 KDM4E (0.50) CYP17A1CYP1A2SRCCYP3A4CYP2D6
SCHEMBL31469628 0.70 SRC (0.39) SRCNOS2NOS3NOS1ABL1
SCHEMBL31018622 0.69 HTR2A (0.31) BACE1
SCHEMBL26596977 0.69 CHEK1 (0.41) SRCPAK4KDM4EALDH1A1LMNA
SCHEMBL26597003 0.69 SRC (0.34) CYP17A1CYP1A2SRCABL1PIK3CD

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-11795192-B2 Antimicrobial compounds, compositions, and uses thereof Lakewood Amedex, Inc. (US) 2023-10-24 US disclosed
US-11795192-B2 Antimicrobial compounds, compositions, and uses thereof Lakewood Amedex, Inc. (US) 2023-10-24 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-11795192-B2 Antimicrobial compounds, compositions, and uses thereof CAT, MPO, NISCH CYP17A1 1740/4885CYP1A2 1218/4885SRC 4392/4885

“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.