SCHEMBL2215747

SCHEMBL2215747

Cc1c(C(=O)NCCN2CCN(c3cccc(Cl)c3Cl)CC2)cc(-c2cccnc2)n1C

nearest known ligand 0.91

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 19/20 0.91
HTR2C P28335 19/20 0.91
SLC6A4 P31645 19/20 0.91
KCNH2 Q12809 6/20 0.91
DRD2 P14416 3/20 0.73
DRD3 P35462 3/20 0.73
HTR1A P08908 2/20 0.73
DRD4 P21917 2/20 0.73
HTR7 P34969 2/20 0.73
HTR6 P50406 2/20 0.73
CYP2C9 P11712 1/20 0.73

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
SCHEMBL2214328 0.95 HTR2A (1.00) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2216082 0.91 HTR2A (0.90) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2214914 0.90 HTR2A (0.91) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL12441289 0.87 HTR2A (0.90) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL12441254 0.87 HTR2A (0.88) HTR2AHTR2CSLC6A4KCNH2DRD2
Hydrochloric Acid SCHEMBL2214843 0.86 HTR2A (0.88) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2214331 0.86 HTR2A (1.00) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2215146 0.86 HTR2A (1.00) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2215659 0.84 HTR2A (1.00) HTR2AHTR2CSLC6A4KCNH2DRD2
SCHEMBL2214712 0.84 HTR2A (0.81) HTR2AHTR2CSLC6A4KCNH2DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895558-B2 Arylpiperazine-containing pyrrole 3-carboxamide derivatives for treating depressive disorders GREEN CROSS CORPORATION (KR) 2014-11-25 US claimed
US-20110178091-A1 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2011-07-21 US claimed
WO-2010038948-A2 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2010-04-08 WO claimed
US-8895558-B2 Arylpiperazine-containing pyrrole 3-carboxamide derivatives for treating depressive disorders GREEN CROSS CORPORATION (KR) 2014-11-25 US disclosed
US-8895558-B2 Arylpiperazine-containing pyrrole 3-carboxamide derivatives for treating depressive disorders GREEN CROSS CORPORATION (KR) 2014-11-25 US disclosed
US-8895558-B2 Arylpiperazine-containing pyrrole 3-carboxamide derivatives for treating depressive disorders GREEN CROSS CORPORATION (KR) 2014-11-25 US disclosed
US-20110178091-A1 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2011-07-21 US disclosed
US-20110178091-A1 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2011-07-21 US disclosed
US-20110178091-A1 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2011-07-21 US disclosed
WO-2010038948-A2 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS GREEN CROSS CORPORATION (KR) 2010-04-08 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-20110178091-A1 ARYLPIPERAZINE-CONTAINING PYRROLE 3-CARBOXAMIDE DERIVATIVES FOR TREATING DEPRESSIVE DISORDERS NPY5R, TPH2, MC5R HTR2A 18/4885HTR2C 10/4885SLC6A4 111/4885

“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.