SCHEMBL25854704

SCHEMBL25854704

CC(C)C(=O)NC12CC(F)(C1)C2

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.41
IDO1 P14902 3/20 0.37
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL25854691 0.81 MAOB (0.34) KMT2ASMN1; SMN2
SCHEMBL24568981 0.79 EPHX2 (0.37) EPHX2IDO1
SCHEMBL25543880 0.77 KMT2A (0.31) KMT2ASMN1; SMN2
SCHEMBL25545350 0.77 GRM1 (0.36) KMT2ASMN1; SMN2
SCHEMBL25857001 0.75 EPHX2 (0.45) EPHX2
SCHEMBL22758640 0.74 IDO1 (0.40) IDO1
SCHEMBL17582410 0.72 EPHX2 (0.39) EPHX2
SCHEMBL29791363 0.71 EPHX2 (0.39) EPHX2IDO1SMN1; SMN2
SCHEMBL25854709 0.71 KMT2A (0.53) EPHX2KMT2ASMN1; SMN2
SCHEMBL21023565 0.71 IRAK4 (0.31) KMT2ASMN1; 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-11708348-B2 Protease inhibitors for treatment of coronavirus infections THE SCRIPPS RESEARCH INSTITUTE (US) 2023-07-25 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-11708348-B2 Protease inhibitors for treatment of coronavirus infections ACE, ACE2, TMPRSS2 EPHX2 2636/4885IDO1 1238/4885KMT2A 2364/4885

“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.