SCHEMBL20293633

SCHEMBL20293633

Cc1ccc(S(=O)(=O)OCCC(C)c2c[nH]c3ccc(C#N)cc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 2/20 0.42
▸ NR3C2 P08235 2/20 0.42
▸ MGAM O43451 4/20 0.41
▸ GAA P10253 4/20 0.41
▸ SI P14410 4/20 0.41
▸ MGAM2 Q2M2H8 4/20 0.41
▸ GUSB P08236 2/20 0.41
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ BCHE P06276 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ SLC6A4 P31645 5/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL9213937 0.82 NR3C1 (0.51) NR3C1NR3C2MGAMGAASI
SCHEMBL16433322 0.80 SLC6A4 (0.55) SLC6A4
SCHEMBL15556005 0.80 SLC6A4 (0.54) SLC6A4
SCHEMBL5239895 0.75 HTR2A (0.48) MGAMGAASIMGAM2GUSB
SCHEMBL15544356 0.72 MAPT (0.63) NR3C1NR3C2MEN1KMT2AKDM4E
SCHEMBL16824131 0.71 HTR6 (0.41) NR3C1NR3C2MEN1KMT2ASLC6A4
SCHEMBL20078269 0.70 GUSB (0.50) MGAMGAASIMGAM2GUSB
SCHEMBL16824124 0.69 SLC6A4 (0.41) NR3C1NR3C2MEN1KMT2AKDM4E
SCHEMBL24842242 0.69 DRD2 (0.41) NR3C1NR3C2KMT2APGRBCHE
SCHEMBL10754767 0.68 GAA (0.42) NR3C1NR3C2MGAMGAASI

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-10316025-B2 Substituted piperazine compounds and methods of use and use thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-06-11 — — US disclosed
US-20180179188-A1 SUBSTITUTED PIPERAZINE COMPOUNDS AND METHODS OF USE AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2018-06-28 — — 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-20180179188-A1 SUBSTITUTED PIPERAZINE COMPOUNDS AND METHODS OF USE AND USE THEREOF HTR5A, HTR2C, TPH1 NR3C1 752/4885NR3C2 401/4885MGAM 4581/4885
US-10316025-B2 Substituted piperazine compounds and methods of use and use thereof HTR5A, HTR2C, TPH1 NR3C1 752/4885NR3C2 401/4885MGAM 4581/4885

“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.

Send feedback