SCHEMBL26028705

SCHEMBL26028705

CC(C)CCOc1cc(F)c(N(C)S(C)(=O)=O)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 1/20 0.38
MMP3 P08254 1/20 0.36
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
TP53 P04637 2/20 0.33
MMP2 P08253 1/20 0.33
MMP13 P45452 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SCN9A Q15858 1/20 0.33
CYP19A1 P11511 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
PDK2 Q15119 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 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
SCHEMBL25321066 0.82 CYP19A1 (0.34) CYP19A1PDK2
SCHEMBL26022218 0.80 TDP1 (0.41) EPHX2TDP1MAPK1MMP3CNR1
SCHEMBL25316861 0.76 TAAR1 (0.39) CYP19A1
SCHEMBL25902816 0.73 GPR119 (0.47) EPHX2TDP1MAPK1MMP3TP53
SCHEMBL25315858 0.72 CYP19A1 (0.34) TP53SMN1; SMN2CYP19A1HTT
SCHEMBL25903076 0.71 MAPK1 (0.47) EPHX2TDP1MAPK1CNR1CNR2
SCHEMBL21340057 0.70 TDP1 (0.50) EPHX2TDP1MAPK1CNR1CNR2
SCHEMBL25903065 0.69 TDP1 (0.42) EPHX2TDP1MAPK1MMP3CNR1
SCHEMBL21218072 0.68 TDP1 (0.49) EPHX2TDP1MAPK1TP53SMN1; SMN2
SCHEMBL26022176 0.68 MAPK1 (0.48) EPHX2TDP1MAPK1L3MBTL1PDK2

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-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE HERCULES CAPITAL, INC., AS AGENT 2023-08-24 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-20230265096-A1 APOL1 INHIBITORS AND METHODS OF USE APOL1, APOB, LDLR EPHX2 2977/4885TDP1 761/4885MAPK1 1518/4885

“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.