SCHEMBL6166555

SCHEMBL6166555

CN(C)C(c1c[nH]c2ccccc12)S(=O)(=O)c1ccc2c(c1)CCNCC2

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 17/20 0.48
HTR2B P41595 14/20 0.48
KCNH2 Q12809 1/20 0.39
PNMT P11086 2/20 0.39
HTR6 P50406 1/20 0.37

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
SCHEMBL6335591 0.94 PNMT (0.47) HTR2CHTR2BPNMT
SCHEMBL6330562 0.81 L3MBTL1 (0.35) HTR2CHTR2B
SCHEMBL6323286 0.75 HTR2C (0.61) HTR2CHTR2BPNMTHTR6
Hydrochloric Acid SCHEMBL6330314 0.74 HTR2C (0.60) HTR2CHTR2BPNMTHTR6
SCHEMBL4773205 0.67 HTR2C (1.00) HTR2CHTR2BKCNH2PNMT
SCHEMBL4030704 0.65 PNMT (0.81) HTR2CHTR2BPNMT
SCHEMBL6166337 0.64 HTR2C (0.59) HTR2CHTR2BHTR6
SCHEMBL5455774 0.64 HTR2C (1.00) HTR2CHTR2BPNMTHTR6
Hydrochloric Acid SCHEMBL10350527 0.63 PNMT (0.78) HTR2CHTR2BPNMT
SCHEMBL4767812 0.62 HTR2C (0.64) HTR2CHTR2BPNMT

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-1392316-B1 BENZO[D]AZEPINE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS. SMITHKLINE BEECHAM PLC (GB) 2005-04-20 EP claimed
US-20040192671-A1 Benzo[d]azepine derivatives as 5-ht6 receptor anatagonists SMITHKLINE BEECHAM P.L.C. (GB) 2004-09-30 US claimed
EP-1392316-A1 BENZO[D]AZEPINE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS. SMITHKLINE BEECHAM PLC (GB) 2004-03-03 EP claimed
WO-2002089811-A1 BENZO[D]AZEPINE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-11-14 WO claimed
EP-1392316-B1 BENZO[D]AZEPINE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS. SMITHKLINE BEECHAM PLC (GB) 2005-04-20 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-20040192671-A1 Benzo[d]azepine derivatives as 5-ht6 receptor anatagonists HTR6, HTR5A, HTR1A HTR2C 7/4885HTR2B 14/4885KCNH2 951/4885

“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.