SCHEMBL6410070

SCHEMBL6410070

O=[N+]([O-])c1ccc(F)c(C2=CCNCC2)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.53
HTR2A P28223 1/20 0.53
ADRA2A P08913 1/20 0.44
PNMT P11086 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HIF1A Q16665 1/20 0.44
HTR2C P28335 5/20 0.42
KHK P50053 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
AMY1A P0DUB6 1/20 0.38

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
SCHEMBL10036372 0.89 HTR6 (0.53) HTR6HTR2AADRA2APNMTALDH1A1
SCHEMBL31333875 0.89 HTR6 (0.53) HTR6HTR2AADRA2APNMTALDH1A1
Hydrochloric Acid SCHEMBL17630885 0.81 HTR6 (0.59) HTR6HTR2AADRA2APNMTALDH1A1
SCHEMBL520900 0.81 HTR6 (0.59) HTR6HTR2AADRA2APNMTALDH1A1
SCHEMBL4775022 0.80 HTR6 (0.53) HTR6HTR2AADRA2APNMTALDH1A1
SCHEMBL519626 0.80 HTR6 (0.50) HTR6HTR2AADRA2APNMTALDH1A1
Hydrochloric Acid SCHEMBL9958496 0.79 HTR2C (0.57) HTR6HTR2AADRA2APNMTHTR2C
SCHEMBL519662 0.77 HTR6 (0.53) HTR6HTR2AADRA2APNMTALDH1A1
SCHEMBL5321082 0.77 HTR6 (0.50) HTR6HTR2AHTR2CSIGMAR1
SCHEMBL4789631 0.77 HTR2C (0.56) HTR6HTR2AADRA2APNMTHTR2C

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-20050154020-A1 4-Aryl piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2005-07-14 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-20050154020-A1 4-Aryl piperidines MCHR1, MCHR2, MC1R HTR6 54/4885HTR2A 48/4885ADRA2A 90/4885

“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.