SCHEMBL25820303

SCHEMBL25820303

CC(C)NC(=O)c1ccnc(C(C)C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.57
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
PROKR1 Q8TCW9 1/20 0.43
RET P07949 1/20 0.43
RIPK1 Q13546 1/20 0.43
HPGDS O60760 1/20 0.43
MLYCD O95822 1/20 0.42
ROCK2 O75116 3/20 0.42
CYP3A4 P08684 1/20 0.42
CYP3A5 P20815 1/20 0.42
XDH P47989 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAF1 P04049 3/20 0.41
BRAF P15056 3/20 0.41
NPC1 O15118 1/20 0.40

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
SCHEMBL22924504 0.87 FDPS (0.55) FDPSNPSR1MEN1LMNAMAPK1
SCHEMBL14566838 0.85 PLK1 (0.46) FDPSMEN1LMNAMAPK1KMT2A
SCHEMBL30007857 0.83 KDM4E (0.50) FDPSMEN1LMNAMAPK1KMT2A
SCHEMBL4000772 0.83 KDM4E (0.50) FDPSMEN1LMNAMAPK1KMT2A
SCHEMBL8953772 0.81 KDM4E (0.57) MAPK1PROKR1CYP3A4XDHMAPT
SCHEMBL20812639 0.81 FDPS (0.58) FDPSNPSR1MEN1LMNAMAPK1
SCHEMBL13323899 0.80 FDPS (0.57) FDPSNPSR1MEN1LMNAMAPK1
SCHEMBL13702150 0.80 FDPS (0.57) FDPSNPSR1MEN1LMNAMAPK1
SCHEMBL2801067 0.80 FDPS (0.57) FDPSNPSR1MEN1LMNAMAPK1
SCHEMBL1759894 0.79 KDM4C (0.55) PROKR1MAPTALDH1A1

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 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-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA FDPS 3346/4885NPSR1 4200/4885MEN1 1172/4885

“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.