SCHEMBL5997497

SCHEMBL5997497

CC(C)CN(Cc1cccc(Cl)c1C(F)(F)F)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 10/20 0.45
SLC6A4 P31645 10/20 0.45
SLC6A3 Q01959 4/20 0.45
STS P08842 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GPR119 Q8TDV5 5/20 0.43
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL5993914 0.85 SLC6A2 (0.59) SLC6A2SLC6A4SLC6A3MEN1KMT2A
Acetic Acid SCHEMBL5993263 0.82 SLC6A2 (0.58) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL5992970 0.80 GPR119 (0.46) STSMEN1KMT2AGPR119
SCHEMBL5996682 0.79 SLC6A2 (0.59) SLC6A2SLC6A4MEN1KMT2AGPR119
SCHEMBL5993906 0.79 SLC6A4 (0.51) SLC6A2SLC6A4SLC6A3STSMEN1
SCHEMBL3267607 0.79 GPR119 (0.44) GPR119
SCHEMBL3269535 0.79 GPR119 (0.44) MEN1KMT2AGPR119
SCHEMBL5995305 0.78 GPR119 (0.49) GPR119
SCHEMBL3267888 0.78 CYP3A4 (0.42) MEN1KMT2AGPR119MAPK1
Fumaric Acid SCHEMBL5994025 0.76 SLC6A2 (0.78) SLC6A2SLC6A4SLC6A3

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 SLC6A2 1/4885SLC6A4 4/4885SLC6A3 3/4885

“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.