SCHEMBL10035602

SCHEMBL10035602

COc1cccc(S(=O)(=O)NCCCN2CCc3cc(OC)c(OC)cc3C2)c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.58
HTR7 P34969 6/20 0.57
DRD4 P21917 1/20 0.54
DRD3 P35462 1/20 0.54
ABCC1 P33527 1/20 0.52

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
Hydrochloric Acid SCHEMBL2137282 0.99 ABCB1 (0.57) ABCB1HTR7DRD4DRD3ABCC1
SCHEMBL8982250 0.97 DRD4 (0.58) ABCB1HTR7DRD4DRD3
Hydrochloric Acid SCHEMBL4228196 0.96 DRD4 (0.57) ABCB1HTR7DRD4DRD3
SCHEMBL10035588 0.90 HTR7 (0.57) ABCB1HTR7DRD3
SCHEMBL10035522 0.90 HTR7 (0.72) HTR7
SCHEMBL5402012 0.90 HTR7 (0.71) ABCB1HTR7
SCHEMBL10035561 0.89 HTR7 (0.56) ABCB1HTR7DRD4DRD3
SCHEMBL10035612 0.89 L3MBTL1 (0.57) ABCB1HTR7DRD3
Hydrochloric Acid SCHEMBL2136320 0.89 HTR7 (0.56) ABCB1HTR7DRD3
SCHEMBL14503621 0.89 HTR7 (0.56) ABCB1HTR7DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8148397-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-04-03 US disclosed
US-8148397-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-04-03 US disclosed
US-20090088450-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-04-02 US disclosed
US-20090088450-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-04-02 US disclosed
US-7211584-B2 5-HT7 receptor ligands LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-05-01 US disclosed
US-7211584-B2 5-HT7 receptor ligands LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-05-01 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-20090088450-A1 5-ht7 receptor antagonists HTR7, HTR1A, HTR5A ABCB1 551/4885HTR7 1/4885DRD4 115/4885

“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.