SCHEMBL5994154

SCHEMBL5994154

CC(C)(C)OC(=O)N1CCC(N(CCCC#N)Cc2ccc(F)cc2C(F)(F)F)CC1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 0.62
SLC6A2 P23975 17/20 0.62
EPHX2 P34913 1/20 0.45
GPR119 Q8TDV5 1/20 0.44

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
SCHEMBL6205072 0.88 SLC6A4 (0.61) SLC6A4SLC6A2
SCHEMBL5997831 0.86 SLC6A4 (0.65) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL5995931 0.85 SLC6A4 (0.51) SLC6A4SLC6A2EPHX2
SCHEMBL5997164 0.84 SLC6A4 (0.61) SLC6A4SLC6A2EPHX2
SCHEMBL16269692 0.82 EPHX2 (0.53) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL5994452 0.82 EPHX2 (0.48) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL16268663 0.79 EPHX2 (0.50) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL16269490 0.79 JAK2 (0.52) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL6186753 0.79 EPHX2 (0.48) SLC6A4SLC6A2EPHX2GPR119
SCHEMBL5992943 0.76 SLC6A4 (0.62) SLC6A4SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060079554-A1 Inhibitors of monomine uptake ELI LILLY AND COMPANY 2006-04-13 US disclosed
EP-1569905-A2 INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2005-09-07 EP disclosed
WO-2004052858-A2 INHIBITORS OF MONOAMINE UPTAKE ELI LILLY AND COMPANY (US) 2004-06-24 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-20060079554-A1 Inhibitors of monomine uptake SLC6A2, SLC18A2, SLC6A3 SLC6A4 4/4885SLC6A2 1/4885EPHX2 3350/4885

“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.