SCHEMBL10035558

SCHEMBL10035558

COc1cc2c(cc1OC)CN(CCCNS(=O)(=O)c1ccc(Cl)cc1)CC2

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.56
DRD2 P14416 2/20 0.55
DRD3 P35462 2/20 0.55
DRD1 P21728 1/20 0.55
DRD4 P21917 1/20 0.55
KMT2A Q03164 1/20 0.55
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR6 P50406 1/20 0.53
CCR1 P32246 2/20 0.53
ABCB1 P08183 3/20 0.53
DHCR7 Q9UBM7 1/20 0.52
POLB P06746 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 SCHEMBL2140245 0.99 HTR7 (0.55) HTR7DRD2DRD3DRD1DRD4
SCHEMBL5410338 0.97 DRD3 (0.59) HTR7DRD2DRD3DRD1DRD4
Hydrochloric Acid SCHEMBL4224036 0.96 DRD3 (0.58) HTR7DRD2DRD3DRD1DRD4
SCHEMBL8980793 0.96 DRD3 (0.58) HTR7DRD2DRD3DRD1DRD4
Hydrochloric Acid SCHEMBL4218459 0.95 DRD3 (0.58) HTR7DRD2DRD3DRD1DRD4
SCHEMBL2138032 0.91 HTR7 (0.57) HTR7ABCB1POLB
SCHEMBL10035624 0.91 MBTD1 (0.59) HTR7DRD2DRD3HTR2AABCB1
SCHEMBL10035555 0.91 ABCB1 (0.54) HTR7DRD2DRD3DRD1DRD4
SCHEMBL10035595 0.91 ABCB1 (0.64) HTR7DRD3DRD4KMT2AHTR2A
SCHEMBL10035603 0.90 HTR7 (0.54) HTR7DRD2HTR2AHTR2CHTR6

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 1/4885DRD2 42/4885DRD3 157/4885

“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.