SCHEMBL6180265

SCHEMBL6180265

CC(=O)n1cc(CC2CCCN2C)c2cc(C(C)S(=O)(=O)c3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.53
HTR1B P28222 2/20 0.41
HTR1D P28221 1/20 0.41
CHRM2 P08172 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CHRM1 P11229 1/20 0.41
DRD1 P21728 1/20 0.41
SLC6A2 P23975 1/20 0.41
OPRM1 P35372 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41

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
SCHEMBL8875999 0.81 HTR6 (0.53) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL1067210 0.81 CHRM2 (0.64) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL1067208 0.81 CHRM2 (0.64) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL7079772 0.81 HTR6 (0.53) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL722273 0.80 HTR6 (0.54) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL1697440 0.80 HTR6 (0.54) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL773348 0.80 HTR6 (0.54) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL774709 0.80 HTR6 (0.54) HTR6HTR1BCHRM2HTR1AADRA2A
SCHEMBL8789709 0.78 HTR1B (0.70) HTR6HTR1BHTR1DCHRM2HTR1A
SCHEMBL2180885 0.77 HTR6 (0.46) HTR6HTR1BHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1373254-B1 Process for the preparation of the anti-migraine drug eletriptan PFIZER LTD (GB) 2005-11-02 EP disclosed
US-20030166704-A1 New process PFIZER INC. 2003-09-04 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-20030166704-A1 New process TFPI, HTR4, HTR5A HTR6 20/4885HTR1B 32/4885HTR1D 24/4885

“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.