SCHEMBL4433500

SCHEMBL4433500

CS(=O)(=O)c1ncncn1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL9625882 0.78 LMNA (0.43) LMNASMN1; SMN2
SCHEMBL569903 0.77 HSP90AA1 (0.38) HSP90AA1
SCHEMBL1118141 0.74 LMNA (0.43) LMNASMN1; SMN2
SCHEMBL2333580 0.72 HSP90AA1 (0.41) HSP90AA1
SCHEMBL21247994 0.72 HSP90AA1 (0.41) HSP90AA1
SCHEMBL7558103 0.72 HSP90AA1 (0.35) SMN1; SMN2HSP90AA1
Pyridine SCHEMBL28431692 0.70 TDP1 (0.41) LMNASMN1; SMN2
SCHEMBL5252407 0.70 LMNA (0.37) LMNASMN1; SMN2
SCHEMBL765855 0.70 APLNR (0.41) LMNASMN1; SMN2
Hydrogen Sulfide SCHEMBL8036769 0.70 HSP90AA1 (0.33) HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605163-B2 Benzoyl-piperazine derivatives HOFFMANN-LA ROCHE INC. (US) 2009-10-20 US disclosed
US-20080119486-A1 BENZOYL-PIPERAZINE DERIVATIVES JOLIDON SYNESE 2008-05-22 US disclosed
US-7319099-B2 Such as 1-{3-fluoro-4-[4-(2-isopropoxy-5-methanesulfonyl benzoyl)-piperazin-1-yl]-phenyl}-ethanone for treatment of psychoses, pain, neurodegenerative disfunction in memory and learning, schizophrenia, dementia, attention deficit disorders, or Alzheimer's disease HOFFMANN-LA ROCHE INC. (US) 2008-01-15 US disclosed
US-20050209241-A1 Benzoyl-piperazine derivatives HOFFMANN-LA ROCHE INC. 2005-09-22 US disclosed
EP-0665255-B1 N-Methylol derivates of polycondensates based on ureas and polyamines DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-05-30 EP disclosed
US-5569724-A AGENTS FOR IMPROVING WETFASTNESS OF DYEINGS ON CELLULOSE AND CELLULOSE BLEND FABRICS BAYER AKTIENGESELLSCHAFT (DE) 1996-10-29 US disclosed
EP-0665255-A2 N-Methylol derivates of polycondensates based on ureas and polyamines BAYER AG (DE) 1995-08-02 EP disclosed
WO-1991013065-A1 6-ARYL-2-SUBSTITUTED BENZOIC ACID HERBICIDES FMC CORPORATION (US) 1991-09-05 WO 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-20050209241-A1 Benzoyl-piperazine derivatives SLC1A2, SLC18A2, SLC6A7 LMNA 4719/4885SMN1; SMN2 1268/4885HSP90AA1 763/4885
US-20080119486-A1 BENZOYL-PIPERAZINE DERIVATIVES SLC1A2, SLC18A2, SLC6A7 LMNA 4719/4885SMN1; SMN2 1268/4885HSP90AA1 763/4885

“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.