SCHEMBL26081072

SCHEMBL26081072

Fc1ccc(CC2(F)CCCCC2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
HTR2A P28223 8/20 0.41
HTR2C P28335 8/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TRPA1 O75762 1/20 0.39
KCNH2 Q12809 6/20 0.38
DRD2 P14416 4/20 0.38
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL26081070 0.83 SLC6A2 (0.41) KDM4ESMN1; SMN2IDO1AGXTHTR2A
SCHEMBL26081071 0.81 KDM4E (0.47) KDM4ESMN1; SMN2IDO1AGXTHTR2A
SCHEMBL26081047 0.79 RORC (0.39) HTR2AHTR2CKCNH2DRD2SLC6A4
SCHEMBL31118284 0.78 KDM4E (0.45) KDM4ESMN1; SMN2IDO1AGXTALDH1A1
SCHEMBL31118218 0.77 KDM4E (0.44) KDM4ESMN1; SMN2IDO1AGXTHTR2A
SCHEMBL31118258 0.76 KMT2A (0.45) KDM4ESMN1; SMN2IDO1AGXTALDH1A1
SCHEMBL31118253 0.75 KDM4E (0.41) KDM4ESMN1; SMN2IDO1AGXTHTR2A
SCHEMBL14337906 0.73 SLC6A3 (0.44) IDO1ALDH1A1TRPA1SLC6A4SLC6A3
SCHEMBL31118100 0.72 KMT2A (0.45) KDM4ESMN1; SMN2IDO1AGXTALDH1A1
SCHEMBL26081074 0.69 SLC6A3 (0.38) SMN1; SMN2IDO1ALDH1A1SLC6A4SLC6A3

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 KDM4E 1884/4885SMN1; SMN2 431/4885IDO1 1516/4885

“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.