SCHEMBL21066151

SCHEMBL21066151

C/C=C\c1c(C)cccc1N1CCN(CCCCOc2ccc3ccc(OCOCC4=CCCC=C4)nc3c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.42
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
DRD2 P14416 10/20 0.40
ADRA1A P35348 1/20 0.40
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL21775922 0.80 DRD3 (0.41) DRD3SLC6A2SLC6A4DRD2ADRA1A
SCHEMBL21775889 0.78 DRD3 (0.40) DRD3SLC6A2SLC6A4DRD2ADRA1A
SCHEMBL20389575 0.73 DRD2 (0.66) DRD3SLC6A2SLC6A4DRD2ADRA1A
SCHEMBL23721734 0.69 DRD3 (0.54) DRD3DRD2HTR1AHTR2A
SCHEMBL14764833 0.69 HTR1A (0.58) DRD3SLC6A2SLC6A4DRD2ADRA1A
SCHEMBL23721736 0.69 DRD3 (0.53) DRD3DRD2HTR1AHTR2A
SCHEMBL23729115 0.69 DRD2 (0.50) DRD3SLC6A2SLC6A4DRD2ADRA1A
SCHEMBL23721371 0.68 DRD3 (0.53) DRD3DRD2HTR1AHTR2A
SCHEMBL23721818 0.68 DRD3 (0.52) DRD3DRD2HTR1AHTR2A
SCHEMBL23721092 0.67 DRD3 (0.51) DRD3DRD2HTR1AHTR2A

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-20190167672-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENE DERIVATIVES AS ANTIPSYCHOTIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-06-06 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-20190167672-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENE DERIVATIVES AS ANTIPSYCHOTIC AGENTS SUZ12, BRPF3, BRD4 DRD3 902/4885SLC6A2 108/4885SLC6A4 24/4885

“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.