SCHEMBL22773285

SCHEMBL22773285

CS(=O)(=O)c1ccc(C(c2ccccc2)C2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 2/20 0.46
DPP4 P27487 2/20 0.46
DPP7 Q9UHL4 2/20 0.46
CCR5 P51681 6/20 0.44
MGLL Q99685 5/20 0.44
OPRD1 P41143 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
SCHEMBL22773313 0.85 GPR119 (0.59)
SCHEMBL22491546 0.85 GPR119 (0.59)
SCHEMBL5492177 0.82 MGLL (0.47) NPY2RDPP4DPP7MGLL
SCHEMBL7859650 0.82 MGLL (0.47) NPY2RDPP4DPP7MGLL
SCHEMBL23211867 0.81 MGLL (0.40) NPY2RDPP4DPP7MGLL
SCHEMBL21381945 0.81 MGLL (0.40) NPY2RDPP4DPP7MGLL
SCHEMBL22491347 0.78 OPRD1 (0.54) OPRD1
SCHEMBL23212042 0.77 CYP3A4 (0.42) DPP4DPP7
SCHEMBL21381659 0.77 CYP3A4 (0.42) DPP4DPP7
SCHEMBL25057228 0.77 KMT2A (0.57) NPY2RMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 US disclosed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 EP disclosed
EP-3717477-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-07-20 EP disclosed
US-20200392125-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2020-12-17 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 (2 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-11981661-B2 Heterocyclic compounds CBR3, BRIX1, CCNY NPY2R 193/4885DPP4 3453/4885DPP7 4228/4885
US-20200392125-A1 HETEROCYCLIC COMPOUNDS LPXN, MLX, CCNY NPY2R 398/4885DPP4 4493/4885DPP7 4718/4885

“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.