SCHEMBL6604370

SCHEMBL6604370

COc1cc2c(cc1N1CC(C)N(C)C(C)C1)N(C(=O)Cc1cccc(C(N)=O)c1C)CC2

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 20/20 0.71
HTR1D P28221 18/20 0.71
HTR1A P08908 6/20 0.64
GHSR Q92847 2/20 0.59

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
SCHEMBL6604372 1.00 HTR1B (0.71) HTR1BHTR1DHTR1AGHSR
SCHEMBL6606651 0.89 HTR1B (0.72) HTR1BHTR1DHTR1AGHSR
SCHEMBL6606654 0.89 HTR1B (0.72) HTR1BHTR1DHTR1AGHSR
SCHEMBL6604928 0.87 HTR1B (0.70) HTR1BHTR1DHTR1AGHSR
SCHEMBL6604930 0.87 HTR1B (0.70) HTR1BHTR1DHTR1AGHSR
SCHEMBL6603745 0.85 HTR1B (0.85) HTR1BHTR1DHTR1AGHSR
SCHEMBL6603741 0.85 HTR1B (0.85) HTR1BHTR1DHTR1AGHSR
SCHEMBL6604699 0.84 HTR1B (0.84) HTR1BHTR1DHTR1AGHSR
SCHEMBL6604697 0.84 HTR1B (0.84) HTR1BHTR1DHTR1AGHSR
SCHEMBL6603215 0.83 HTR1B (1.00) HTR1BHTR1DHTR1AGHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216239-B1 PIPERAZINE DERIVATIVES AS 5-HT1B ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2004-02-11 EP claimed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
US-20040176388-A1 Piperazine derivatives as 5-HT1B antagonists SMITHKLINE BEECHAM P.I.C. 2004-09-09 US disclosed
US-6747030-B1 CIS-6-(3,5-DIMETHYLPIPERAZIN-1-YL)-5-METHOXY-1-(2'-METHYL-4'-( 5-METHYL-1,2,4-OXADIAZOL-3-YL)BIPHENYL-4-CARBONYL)INDOLINE, ITS HYDROCHLORIDE SALT, OR ANOTHER PHARMACEUTICALLY ACCEPTABLE SALT THEREOF; ANTIDEPRESSANTS SMITHKLINE BEECHAM P.L.C. (GB) 2004-06-08 US disclosed
EP-1216239-B1 PIPERAZINE DERIVATIVES AS 5-HT1B ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2004-02-11 EP 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-20040176388-A1 Piperazine derivatives as 5-HT1B antagonists HTR1B, HTR2B, HTR2A HTR1B 1/4885HTR1D 8/4885HTR1A 5/4885

“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.