SCHEMBL7251853

SCHEMBL7251853

Cc1ccc(S(=O)(=O)N(c2cccc(OC(F)(F)F)c2)C2CCN(Cc3ccccc3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.45
CHRM4 P08173 10/20 0.45
OPRM1 P35372 1/20 0.45
ACHE P22303 3/20 0.44
CHRM2 P08172 3/20 0.44
CHRM1 P11229 2/20 0.44
BCHE P06276 2/20 0.43
BACE1 P56817 2/20 0.43
PTGER1 P34995 1/20 0.42

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
SCHEMBL7139282 0.92 ACHE (0.49) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7190540 0.92 CHRM3 (0.46) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7257336 0.91 CHRM3 (0.44) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7198828 0.90 BCHE (0.50) CHRM3CHRM4ACHECHRM2CHRM1
SCHEMBL7167171 0.89 ALDH1A1 (0.48) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7196308 0.89 ACHE (0.51) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7149576 0.87 BCHE (0.54) CHRM4ACHECHRM2CHRM1BCHE
SCHEMBL7142247 0.84 NPSR1 (0.56) CHRM3OPRM1ACHECHRM2BACE1
SCHEMBL7257804 0.84 CHRM2 (0.43) CHRM3CHRM4OPRM1ACHECHRM2
SCHEMBL7256616 0.84 CYP3A4 (0.50) CHRM3OPRM1ACHECHRM2

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-20030176461-A1 Aminopiperidines NPS ALLELIX CORP. (CANADA CORPORATION) (CA) 2003-09-18 US claimed
US-20030176461-A1 Aminopiperidines NPS ALLELIX CORP. (CANADA CORPORATION) (CA) 2003-09-18 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-20030176461-A1 Aminopiperidines SLC1A2, SLC6A4, SLC1A1 CHRM3 369/4885CHRM4 392/4885OPRM1 242/4885

“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.