SCHEMBL26081069

SCHEMBL26081069

FC1(Cc2ccc(Cl)cn2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.47
HTR1A P08908 1/20 0.37
GRM2 Q14416 1/20 0.35
GRM3 Q14832 1/20 0.35
SLC6A4 P31645 5/20 0.34
SLC6A3 Q01959 4/20 0.34
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
P2RX7 Q99572 1/20 0.33
TRPC6 Q9Y210 1/20 0.32
SLC6A2 P23975 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GRM5 P41594 1/20 0.31
CNR2 P34972 1/20 0.31
PDK2 Q15119 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL24484278 0.84 TRPA1 (0.39) TRPA1HTR1AGRM2GRM3TRPC6
SCHEMBL26081068 0.80 TRPA1 (0.50) TRPA1HTR1AGRM2GRM3SLC6A4
SCHEMBL26081138 0.80 HTR1A (0.39) HTR1A
SCHEMBL26081173 0.78 TRPA1 (0.31) TRPA1
SCHEMBL26081212 0.77 HTR1A (0.33) TRPA1HTR1ASLC6A4SLC6A3
SCHEMBL26081079 0.76 RORC (0.38) P2RX7L3MBTL1GRM5HTR7
SCHEMBL26081178 0.75 ALDH1A1 (0.40)
SCHEMBL26081156 0.72 CYP1A2 (0.34) HTR1A
SCHEMBL26081157 0.71 HTR1A (0.33) TRPA1HTR1AP2RX7
SCHEMBL26081146 0.70 TRPA1 (0.47) TRPA1L3MBTL1

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 TRPA1 3975/4885HTR1A 1004/4885GRM2 1581/4885

“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.