SCHEMBL13532575

SCHEMBL13532575

CCCCN1C(=O)C2C(=O)N(CCCCN3CCN(c4ccc(Cl)cc4)CC3)C(=O)C(C1=O)C2(C)C

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
GAA P10253 1/20 0.63
HTR7 P34969 8/20 0.59
DRD2 P14416 7/20 0.59
HTR6 P50406 4/20 0.59
HTR2A P28223 3/20 0.59
HTR1A P08908 3/20 0.59
DRD1 P21728 2/20 0.53
HTR2C P28335 2/20 0.53
ADRA1A P35348 2/20 0.53
DRD5 P21918 1/20 0.51
DRD3 P35462 1/20 0.51
DRD4 P21917 3/20 0.49

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
SCHEMBL13532579 0.95 KDM4E (0.60) KDM4EGAAHTR7DRD2HTR6
SCHEMBL13532573 0.83 KDM4E (0.64) KDM4EHTR7DRD2HTR6HTR2A
SCHEMBL14459608 0.81 KDM4E (0.88) KDM4EGAADRD2HTR2AHTR1A
SCHEMBL16676579 0.80 KDM4E (0.97) KDM4EGAADRD2HTR2AHTR1A
SCHEMBL20048037 0.79 SMN1; SMN2 (0.56) KDM4EHTR7DRD2HTR2AHTR1A
Umespirone SCHEMBL678458 0.76 DRD2 (0.69) KDM4EHTR7DRD2HTR6HTR2A
SCHEMBL10631261 0.75 HTR1A (0.58) HTR7DRD2HTR6HTR2AHTR1A
SCHEMBL13079491 0.74 KDM4E (0.78) KDM4EGAADRD2HTR2AHTR1A
SCHEMBL18754269 0.72 KDM4E (0.75) KDM4EGAADRD2HTR2AHTR1A
SCHEMBL21802068 0.72 HTR1A (0.80) HTR7DRD2HTR6HTR2AHTR1A

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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 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-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS HTR6, GAP43, HTR5A KDM4E 3933/4885GAA 3419/4885HTR7 11/4885

“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.