SCHEMBL26081086

SCHEMBL26081086

CC(C)(C)OC(=O)N1CCC(F)(C(=O)c2ccc(C(F)(F)F)nc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.43
IDH2 P48735 1/20 0.43
HDAC4 P56524 1/20 0.42
GPR119 Q8TDV5 11/20 0.41
RORC P51449 2/20 0.40
NAMPT P43490 1/20 0.40
F13A1 P00488 1/20 0.40
TGM2 P21980 1/20 0.40
TGM1 P22735 1/20 0.40
TACR1 P25103 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL27196781 0.82 SYK (0.45) IDH1IDH2GPR119RORCF13A1
SCHEMBL229653 0.80 KMT2A (0.47) GPR119RORCMEN1KMT2A
SCHEMBL26081084 0.79 MGLL (0.46) IDH1IDH2GPR119TACR1
SCHEMBL5705772 0.79 KMT2A (0.60) GPR119MEN1KMT2A
SCHEMBL16632062 0.79 STS (0.51) GPR119KMT2A
SCHEMBL15565611 0.78 KDM4E (0.50) GPR119RORCTACR1MEN1KMT2A
SCHEMBL26081087 0.78 GPR119 (0.41) IDH1IDH2GPR119F13A1TGM2
SCHEMBL21605904 0.78 USP30 (0.46) HDAC4GPR119TACR1MEN1KMT2A
SCHEMBL30328592 0.78 GPR119 (0.50) GPR119MEN1KMT2A
SCHEMBL26081185 0.77 CNR2 (0.42) NAMPT

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-20230312522-A1 CYP46A1 INHIBITORS AND METHODS OF USE THEREOF SAGE THERAPEUTICS, INC. 2023-10-05 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-20230312522-A1 CYP46A1 INHIBITORS AND METHODS OF USE THEREOF CYP46A1, CYP26A1, CYP4A22 IDH1 887/4885IDH2 631/4885HDAC4 1907/4885

“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.