SCHEMBL29950191

SCHEMBL29950191

O=C1N(CCN2CCN(c3ccc(F)cc3)CC2)CCC12CC=CC2

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.52
ADRA1D P25100 2/20 0.52
ADRA1A P35348 2/20 0.52
ADRA1B P35368 2/20 0.52
DRD2 P14416 2/20 0.52
HTR7 P34969 3/20 0.46
HTR6 P50406 2/20 0.46
HTR2A P28223 1/20 0.46
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
GAA P10253 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
DRD3 P35462 1/20 0.42

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
SCHEMBL29950038 0.89 HTR1A (0.59) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL29950079 0.80 KCNH2 (0.55) HTR1AADRA1BHTR7HTR6HTR2A
SCHEMBL21552534 0.71 HTR7 (0.48) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL21552624 0.71 HTR7 (0.48) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL8011318 0.70 DRD2 (0.69) HTR1ADRD2HTR2ADRD3
SCHEMBL31232816 0.69 ADRA1D (0.71) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6077959 0.68 HTR1A (0.50) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL29950448 0.68 HTR1A (0.61) HTR1AADRA1BHTR7
SCHEMBL16218814 0.68 MAPT (0.56) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL6768778 0.68 HTR1A (0.44) HTR1AADRA1DADRA1AADRA1BDRD2

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-20220306629-A1 NOVEL FUNCTIONALIZED LACTAMS AS MODULATORS OF THE 5-HYDROXYTRYPTAMINE RECEPTOR 7 AND THEIR METHOD OF USE PRAEVENTIX, LLC 2022-09-29 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-20220306629-A1 NOVEL FUNCTIONALIZED LACTAMS AS MODULATORS OF THE 5-HYDROXYTRYPTAMINE RECEPTOR 7 AND THEIR METHOD OF USE HTR7, HTR5A, HTR1A HTR1A 3/4885ADRA1D 102/4885ADRA1A 115/4885

“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.