SCHEMBL10035582

SCHEMBL10035582

COc1cc2c(cc1OC)CN(CCCNS(=O)(=O)c1ccccc1C(F)(F)F)CC2

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 5/20 0.56
HTR7 P34969 3/20 0.56
ABCB1 P08183 3/20 0.51
SIGMAR1 Q99720 1/20 0.51
CCR1 P32246 1/20 0.51
GRIN1 Q05586 1/20 0.50
GRIN2B Q13224 1/20 0.50

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 SCHEMBL2142001 0.99 TMEM97 (0.56) TMEM97HTR7ABCB1SIGMAR1CCR1
SCHEMBL8982649 0.98 TMEM97 (0.58) TMEM97HTR7ABCB1SIGMAR1GRIN1
Hydrochloric Acid SCHEMBL4228324 0.97 TMEM97 (0.57) TMEM97HTR7ABCB1SIGMAR1GRIN1
SCHEMBL10035614 0.86 HTR7 (0.59) TMEM97HTR7ABCB1SIGMAR1GRIN1
SCHEMBL10035541 0.86 HTR7 (0.67) HTR7CCR1
Hydrochloric Acid SCHEMBL2138718 0.85 HTR7 (0.58) TMEM97HTR7ABCB1SIGMAR1GRIN1
SCHEMBL8983649 0.85 HTR7 (0.56) TMEM97HTR7ABCB1SIGMAR1GRIN1
SCHEMBL10035583 0.85 HTR7 (0.58) TMEM97HTR7ABCB1SIGMAR1
SCHEMBL2137287 0.85 HTR7 (0.58) TMEM97HTR7ABCB1SIGMAR1CCR1
Hydrochloric Acid SCHEMBL2139786 0.85 HTR7 (0.66) HTR7CCR1

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 TMEM97 106/4885HTR7 1/4885ABCB1 551/4885

“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.