SCHEMBL20129705

SCHEMBL20129705

CC[C@@H]1CNCCN1c1cc(F)c(F)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.46
SLC6A4 P31645 16/20 0.46
SLC6A3 Q01959 16/20 0.46
CYP2D6 P10635 8/20 0.41
HTR2C P28335 3/20 0.37
ROCK2 O75116 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2B P41595 2/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL20129706 0.86 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL20141013 0.86 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL28168047 0.86 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL5631288 0.85 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5631291 0.85 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5632269 0.85 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL5635953 0.84 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL5635949 0.84 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5631151 0.80 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C
SCHEMBL5631142 0.80 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3CYP2D6HTR2C

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-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. 2018-05-10 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-20180127370-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF MTOR, RICTOR, RPTOR SLC6A2 3251/4885SLC6A4 1595/4885SLC6A3 2743/4885

“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.