SCHEMBL6479209

SCHEMBL6479209

FC(Cc1ccccc1)C1CCCC[N]1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.36
SIGMAR1 Q99720 1/20 0.34
PDE4A P27815 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
EPHX1 P07099 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
NISCH Q9Y2I1 3/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL2254431 0.69 L3MBTL1 (0.33) SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL2202292 0.69 GAA (0.37) SIGMAR1
SCHEMBL42737 0.67 NOS3 (0.53) POLB
SCHEMBL11669280 0.66 NOS3 (0.51) POLB
SCHEMBL11669399 0.66 NOS3 (0.51) POLB
SCHEMBL11572938 0.65 GAA (0.33)
SCHEMBL1968440 0.65 SLC18A2 (0.49)
SCHEMBL11868464 0.64 EPHX1 (0.43) GRIN2BSIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL6885602 0.63 GRIN2B (0.45) GRIN2BSIGMAR1EPHX1MAOAALDH1A1
SCHEMBL447548 0.63 PSEN1 (0.39) SIGMAR1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050033056-A1 Hydroxylated indole derivatives and uses thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-02-10 US disclosed
WO-2003059351-A1 HYDROXYLATED INDOLE DERIVATIVES AND USES THEREOF EISAI CO., LTD. (JP) 2003-07-24 WO 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-20050033056-A1 Hydroxylated indole derivatives and uses thereof TPH2, TPH1, HTR6 GRIN2B 558/4885SIGMAR1 262/4885PDE4A 602/4885

“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.