SCHEMBL3782449

SCHEMBL3782449

CCN(CC)C(=O)n1cnc(S(=O)(=O)c2c(C)nn3ccc(C)nc23)n1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.39
DPP4 P27487 1/20 0.32
PTGS2 P35354 1/20 0.30

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
SCHEMBL3788531 0.84 HTR6 (0.38) HTR6DPP4
SCHEMBL3786924 0.81 HTR6 (0.50) HTR6
SCHEMBL9378261 0.76 DPP4 (0.36) DPP4
SCHEMBL9015525 0.76 NPSR1 (0.34) DPP4
SCHEMBL9015560 0.74 DPP4 (0.33) DPP4
SCHEMBL9015546 0.74 DPP4 (0.33) DPP4
Cafenstrole SCHEMBL54625 0.74 KMT2A (0.49) DPP4
SCHEMBL9015559 0.73 ALDH1A1 (0.39) DPP4
SCHEMBL204666 0.73 DPP4 (0.34) DPP4
SCHEMBL3782113 0.72 HTR6 (0.47) HTR6

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
US-8552005-B2 (EN) 3-sulfonyl-pyrazolo[1,5-a] pyrimidines / antagonists of serotonin 5-HT6 receptors, methods for the production and the use thereof Avincuro Pharmaceuticals, Inc. (US) 2013-10-08 US claimed
US-20100331347-A1 (EN) 3-SULFONYL-PYRAZOLO[1,5-A] PYRIMIDINES / ANTAGONISTS OF SEROTONIN 5-HT6 RECEPTORS, METHODS FOR THE PRODUCTION AND THE USE THEREOF AVINEURO PHARMACEUTICALS, INC. 2010-12-30 US claimed

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-20100331347-A1 (EN) 3-SULFONYL-PYRAZOLO[1,5-A] PYRIMIDINES / ANTAGONISTS OF SEROTONIN 5-HT6 RECEPTORS, METHODS FOR THE PRODUCTION AND THE USE THEREOF HTR6, HTR1A, HTR3A HTR6 1/4885DPP4 2106/4885PTGS2 962/4885

“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.