SCHEMBL10035636

SCHEMBL10035636

COc1cc2c(cc1OC)CN(CCCNS(=O)(=O)c1ccccc1-c1ccccc1)CC2

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.57
ABCB1 P08183 6/20 0.52
GRIN1 Q05586 1/20 0.52
GRIN2B Q13224 1/20 0.52
DRD2 P14416 1/20 0.51
DRD1 P21728 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
ABCC1 P33527 1/20 0.50
CCR1 P32246 1/20 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
Hydrochloric Acid SCHEMBL2140239 0.99 HTR7 (0.56) HTR7ABCB1GRIN1GRIN2BDRD2
SCHEMBL10035614 0.87 HTR7 (0.59) HTR7ABCB1GRIN1GRIN2B
SCHEMBL10035562 0.86 HTR7 (0.63) HTR7ABCB1GRIN1GRIN2BDRD2
Hydrochloric Acid SCHEMBL2138718 0.86 HTR7 (0.58) HTR7ABCB1GRIN1GRIN2B
SCHEMBL2137287 0.86 HTR7 (0.58) HTR7ABCB1GRIN1GRIN2BCCR1
SCHEMBL10035583 0.86 HTR7 (0.58) HTR7ABCB1
SCHEMBL5402012 0.86 HTR7 (0.71) HTR7ABCB1GRIN1GRIN2B
SCHEMBL10035594 0.86 HTR7 (0.71) HTR7DRD2DRD3CCR1
Hydrochloric Acid SCHEMBL2139474 0.85 HTR7 (0.58) HTR7ABCB1
Hydrochloric Acid SCHEMBL2141212 0.85 HTR7 (0.62) HTR7ABCB1GRIN1GRIN2BDRD2

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 4 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

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 HTR7 1/4885ABCB1 551/4885GRIN1 231/4885

“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.