SCHEMBL6701385

SCHEMBL6701385

CC(Oc1ccccc1F)C1CCCCN1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.42
SLC6A2 P23975 5/20 0.42
SLC6A4 P31645 4/20 0.42
DHFR P00374 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL6700346 0.81 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL6699898 0.80 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL4965387 0.79 SLC6A3 (0.50) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL6625146 0.78 SLC6A3 (0.49) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL18707334 0.76 MEN1 (0.41) SLC6A3SLC6A2SLC6A4
SCHEMBL1477095 0.76 SLC6A2 (0.59) SLC6A3SLC6A2SLC6A4
SCHEMBL11712126 0.75 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4
SCHEMBL6757125 0.74 CHRNB4 (0.50) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL7795758 0.74 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL6706606 0.73 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4DHFRALDH1A1

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-20040192673-A1 N-aroyl cyclic amine derivatives as orexin receptor antagonists SMITHKLINE BEECHAM PLC (GB) 2004-09-30 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-20040192673-A1 N-aroyl cyclic amine derivatives as orexin receptor antagonists HCRTR2, HCRTR1, NPY1R SLC6A3 464/4885SLC6A2 196/4885SLC6A4 451/4885

“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.