SCHEMBL26460301

SCHEMBL26460301

CCC(=O)NC(C(C)(C)C)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.48
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
PRSS1 P07477 1/20 0.33
CTSG P08311 1/20 0.33
CTRB1 P17538 1/20 0.33
CMA1 P23946 1/20 0.33
CYP1A2 P05177 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PSMB5 P28074 1/20 0.32
TSHR P16473 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
ALDH1A1 P00352 3/20 0.30
TDP1 Q9NUW8 2/20 0.30
FFAR3 O14843 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL16298847 0.78 CYP2C9 (0.46) CYP2C9MEN1KMT2ASMN1; SMN2PSMB5
SCHEMBL19882969 0.78 CYP2C9 (0.46) CYP2C9MEN1KMT2APSMB5
SCHEMBL31483043 0.78 CYP2C9 (0.46) CYP2C9MEN1KMT2ASMN1; SMN2PSMB5
SCHEMBL25583790 0.76 CYP2C9 (0.45) CYP2C9MEN1KMT2APRSS1CTSG
SCHEMBL10066634 0.76 CYP2C9 (0.45) CYP2C9MEN1KMT2APRSS1CTSG
SCHEMBL12824834 0.75 CYP2C9 (0.43) CYP2C9MEN1KMT2APRSS1CTSG
SCHEMBL26462890 0.75 MEN1 (0.33) MEN1KMT2A
SCHEMBL4341550 0.73 PIK3CD (0.33)
SCHEMBL24441870 0.73 CYP2C9 (0.42) CYP2C9MEN1KMT2AALDH1A1MAPK1
SCHEMBL12401401 0.73 CYP2C9 (0.42) CYP2C9MEN1KMT2ACYP1A2SMN1; SMN2

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-20230140238-A1 ANTI-VIRAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-05-04 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-20230140238-A1 ANTI-VIRAL COMPOUNDS EIF2AK2, ZC3HAV1, HAVCR2 CYP2C9 2985/4885MEN1 1494/4885KMT2A 4121/4885

“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.