SCHEMBL6220537

SCHEMBL6220537

Cc1c(C)c2cc(CCN3CCN(c4noc5cc(F)ccc45)CC3)ccc2[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 11/20 0.51
DRD2 P14416 9/20 0.51
HTR7 P34969 5/20 0.48
HTR1A P08908 4/20 0.47
KCNH2 Q12809 2/20 0.46
HTR6 P50406 2/20 0.42
ABCC1 P33527 5/20 0.41
HRH3 Q9Y5N1 2/20 0.41
SLC22A2 O15244 1/20 0.41
CACNA1F O60840 1/20 0.41
ADRB2 P07550 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2D6 P10635 1/20 0.41
CHRM1 P11229 1/20 0.41
TSHR P16473 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41

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
SCHEMBL6746091 0.93 HTR2A (0.47) HTR2ADRD2HTR7HTR1AHTR6
SCHEMBL6220399 0.88 HTR2A (0.51) HTR2ADRD2HTR7HTR1AHTR6
Hydrochloric Acid SCHEMBL6750990 0.88 HTR2A (0.50) HTR2ADRD2HTR7HTR1AHTR6
SCHEMBL6746149 0.84 DRD2 (0.59) HTR2ADRD2HTR7HTR1AKCNH2
SCHEMBL6748889 0.84 ABCC1 (0.41) HTR2ADRD2HTR7HTR1AHTR6
SCHEMBL6223321 0.84 HTR1A (0.51) HTR2ADRD2HTR7HTR1AKCNH2
SCHEMBL6743912 0.81 HTR1A (0.53) HTR2ADRD2HTR7HTR1AKCNH2
SCHEMBL6184200 0.78 HTR2A (0.49) HTR2ADRD2HTR7HTR1AKCNH2
SCHEMBL6747869 0.76 PARP1 (0.49) HTR2ADRD2HTR7HTR1AABCC1
SCHEMBL6747864 0.75 HTR1A (0.44) HTR2ADRD2HTR7HTR1AABCC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546143-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA Warner-Lambert Company LLC (US) 2005-06-29 EP disclosed
US-20040138230-A1 Heterocyclic substituted piperazines for the treatment of schizophrenia ANDREANA TONJA LYNN (US) 2004-07-15 US disclosed
WO-2004026864-A1 HETEROCYCLIC SUBSTITUTED PIPERAZINES FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2004-04-01 WO 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 HTR2A 16/4885DRD2 2/4885HTR7 119/4885

“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.