SCHEMBL5994302

SCHEMBL5994302

CC(C)(C)OC(=O)N1CCC(N(Cc2ccccc2C(F)(F)F)CC2CC2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.56
SLC6A4 P31645 8/20 0.56
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SLC6A3 Q01959 2/20 0.46
JAK2 O60674 1/20 0.46
JAK1 P23458 1/20 0.46
KDM4E B2RXH2 1/20 0.45
PKM P14618 1/20 0.45
EPHX2 P34913 1/20 0.45
GPR119 Q8TDV5 3/20 0.44
PGR P06401 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL5996937 0.90 SLC6A2 (0.57) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL5995606 0.89 SLC6A2 (0.51) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL5996956 0.87 SLC6A2 (0.58) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL5993914 0.87 SLC6A2 (0.59) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL4687364 0.84 PGR (0.43) SLC6A2SLC6A4MEN1KMT2ASLC6A3
Acetic Acid SCHEMBL5993263 0.84 SLC6A2 (0.58) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL5996568 0.83 SLC6A2 (0.55) SLC6A2SLC6A4MEN1KMT2AJAK2
SCHEMBL5993906 0.83 SLC6A4 (0.51) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL5993248 0.82 MEN1 (0.47) SLC6A2SLC6A4MEN1KMT2ASLC6A3
SCHEMBL4690064 0.82 SLC6A2 (0.53) SLC6A2SLC6A4MEN1KMT2AJAK2

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 4/4885MEN1 876/4885

“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.