SCHEMBL26081084

SCHEMBL26081084

CC(C)(C)OC(=O)N1CCC(F)(Cc2ccc(C(F)(F)F)nc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.46
GPR119 Q8TDV5 13/20 0.44
TACR1 P25103 1/20 0.43
PPARD Q03181 1/20 0.42
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
USP1 O94782 1/20 0.41
MMP13 P45452 1/20 0.41
ADAM17 P78536 1/20 0.41
IDH1 O75874 1/20 0.41
IDH2 P48735 1/20 0.41

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
SCHEMBL22719293 0.85 MGLL (0.43) MGLLGPR119TACR1PPARDMMP13
SCHEMBL3661148 0.82 GPR119 (0.44) MGLLGPR119TACR1MMP13ADAM17
SCHEMBL209368 0.81 PPARD (0.59) MGLLGPR119PPARD
SCHEMBL14155585 0.81 NAMPT (0.46) MGLL
SCHEMBL14357682 0.80 KDM1A (0.48) TACR1OPRD1OPRK1
SCHEMBL21765280 0.80 MGLL (0.46) MGLLGPR119TACR1PPARDOPRD1
SCHEMBL24485248 0.79 MEN1 (0.52) MGLLTACR1OPRD1OPRK1
SCHEMBL18321733 0.79 RORC (0.45) GPR119TACR1OPRD1OPRK1MMP13
SCHEMBL25133820 0.79 GPR119 (0.52) GPR119TACR1OPRD1OPRK1
SCHEMBL26081086 0.79 IDH1 (0.43) GPR119TACR1IDH1IDH2

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 MGLL 2002/4885GPR119 721/4885TACR1 1837/4885

“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.