SCHEMBL7209911

SCHEMBL7209911

Cc1cccc(N2CCN(CCC(N)OC(=O)/C=C(/C(=O)OC(N)CCN3CCN(c4cccc(C)c4C)CC3)c3cc(C)c4ccccc4n3)CC2)c1C

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.45
HTR2A P28223 8/20 0.44
HTR2C P28335 8/20 0.44
DRD2 P14416 4/20 0.44
HTR1A P08908 2/20 0.44
SLC6A4 P31645 6/20 0.41
DRD3 P35462 3/20 0.41
TSHR P16473 1/20 0.40
ADRA1A P35348 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
ABCB1 P08183 2/20 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
SCHEMBL8520611 0.73 HTR1A (0.46) HTR7DRD2HTR1ADRD3MEN1
SCHEMBL7205499 0.70 HTR2A (0.48) HTR7HTR2AHTR2CDRD2HTR1A
Fumaric Acid SCHEMBL7205491 0.68 DRD2 (0.55) HTR7HTR2AHTR2CDRD2HTR1A
Fumaric Acid SCHEMBL7205504 0.68 DRD2 (0.55) HTR7HTR2AHTR2CDRD2HTR1A
SCHEMBL2113444 0.63 ALDH1A1 (0.64) HTR7TSHRMEN1ALDH1A1KMT2A
SCHEMBL10838542 0.63 ALDH1A1 (0.60) HTR2AHTR2CDRD2HTR1ASLC6A4
SCHEMBL15105965 0.62 HTR7 (0.59) HTR7HTR2AHTR2CDRD2HTR1A
SCHEMBL5011344 0.62 HPGD (0.67) TSHRMEN1ALDH1A1KMT2AABCB1
SCHEMBL7205882 0.62 DRD2 (0.49) HTR7HTR2AHTR2CDRD2HTR1A
SCHEMBL5009458 0.62 ALDH1A1 (0.61) HTR7HTR2AHTR2CDRD2HTR1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6613901-B2 For therapy and prophylaxis of neuropsychochological disorders such as schizophrenia and other central nervous system diseases NEUROGEN CORPORATION 2003-09-02 US disclosed
US-20020143019-A1 2-aminoalkylaminoquinolines as dopamine D4 ligands NEUROGEN CORPORATION 2002-10-03 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-20020143019-A1 2-aminoalkylaminoquinolines as dopamine D4 ligands SLC6A3, DRD4, ADRA2C HTR7 102/4885HTR2A 80/4885HTR2C 10/4885

“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.