SCHEMBL8980483

SCHEMBL8980483

COc1ccc(OC)c(S(=O)(=O)NCCCCCN2CCc3ccccc3C2)c1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 8/20 0.60
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTR6 P50406 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
L3MBTL3 Q96JM7 1/20 0.51

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 SCHEMBL4228585 0.99 HTR7 (0.59) HTR7ALDH1A1SMN1; SMN2HTR6TDP1
SCHEMBL8980493 0.99 HTR7 (0.61) HTR7ALDH1A1SMN1; SMN2HTR6TDP1
Hydrochloric Acid SCHEMBL4228361 0.98 HTR7 (0.60) HTR7ALDH1A1SMN1; SMN2HTR6TDP1
SCHEMBL10035526 0.96 HTR7 (0.60) HTR7ALDH1A1SMN1; SMN2TDP1L3MBTL3
Hydrochloric Acid SCHEMBL2138648 0.95 HTR7 (0.59) HTR7ALDH1A1SMN1; SMN2TDP1L3MBTL3
SCHEMBL8982473 0.90 ABCB1 (0.58)
SCHEMBL8980425 0.90 HTR7 (0.59) HTR7SMN1; SMN2HTR6
SCHEMBL8982851 0.90 HTR7 (0.59) HTR7SMN1; SMN2HTR6
Hydrochloric Acid SCHEMBL4224381 0.89 ABCB1 (0.57)
Hydrochloric Acid SCHEMBL4233155 0.89 HTR7 (0.58) HTR7SMN1; SMN2HTR6

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-8188115-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-05-29 US disclosed
US-8188115-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2012-05-29 US disclosed
US-20090163542-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-06-25 US disclosed
US-20090163542-A1 5-ht7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2009-06-25 US disclosed
US-7211585-B2 5-HT7 receptor antagonists LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-05-01 US disclosed
US-7211585-B2 5-HT7 receptor antagonists 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-20090163542-A1 5-ht7 receptor antagonists HTR7, HTR1A, HTR5A HTR7 1/4885ALDH1A1 2903/4885SMN1; SMN2 970/4885

“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.