SCHEMBL6746149

SCHEMBL6746149

Cc1c(C)c2cc(CCN3CCC(c4noc5cc(F)ccc45)CC3)ccc2[nH]c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.59
SLC6A4 P31645 2/20 0.59
ACHE P22303 3/20 0.57
HTR2A P28223 9/20 0.57
HTR1A P08908 6/20 0.57
HRH3 Q9Y5N1 6/20 0.57
KCNH2 Q12809 4/20 0.56
HTR2C P28335 3/20 0.56
ADRA1A P35348 3/20 0.56
HRH1 P35367 3/20 0.56
DRD3 P35462 3/20 0.56
HTR6 P50406 3/20 0.56
SLC22A2 O15244 1/20 0.56
CACNA1F O60840 1/20 0.56
ADRB2 P07550 1/20 0.56
CHRM2 P08172 1/20 0.56
CHRM4 P08173 1/20 0.56
CHRM5 P08912 1/20 0.56
ADRA2A P08913 1/20 0.56
CYP2D6 P10635 1/20 0.56

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
SCHEMBL6220537 0.84 HTR2A (0.51) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL6221138 0.84 HTR1D (0.45) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL6746091 0.79 HTR2A (0.47) DRD2HTR2AHTR1AHTR6HTR7
SCHEMBL9382847 0.78 ACHE (0.68) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL9133023 0.78 DRD2 (0.59) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL9133222 0.78 DRD2 (0.61) DRD2SLC6A4ACHEHTR2AHTR1A
Hydrochloric Acid SCHEMBL9134381 0.77 DRD2 (0.58) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL6746214 0.77 DRD2 (0.58) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL1545611 0.77 ACHE (0.93) DRD2SLC6A4ACHEHTR2AHTR1A
SCHEMBL9131492 0.77 DRD2 (0.60) DRD2SLC6A4ACHEHTR2AHTR1A

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-20040138230-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia ANDREANA TONJA LYNN (US) 2004-07-15 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-20040138230-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia CNR1, DRD2, CNR2 DRD2 2/4885SLC6A4 938/4885ACHE 805/4885

“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.