SCHEMBL6019960

SCHEMBL6019960

N#CCNC(=O)C(Cc1ccc2ccccc2c1)NS(=O)(=O)c1cccs1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
HTT P42858 1/20 0.62
TSHR P16473 1/20 0.59
CTSS P25774 6/20 0.57
CTSB P07858 5/20 0.57
CTSL P07711 4/20 0.57
CTSK P43235 3/20 0.57
MAPT P10636 3/20 0.56
TP53 P04637 2/20 0.56
THRB P10828 1/20 0.56
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.47
CTSC P53634 1/20 0.46
PTGER1 P34995 1/20 0.45
PTGER4 P35408 1/20 0.45
PTGER3 P43115 1/20 0.45
PTGER2 P43116 1/20 0.45

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
SCHEMBL6019981 0.91 TSHR (0.56) ALDH1A1SMN1; SMN2HTTTSHRCTSS
SCHEMBL6021523 0.88 TSHR (0.74) ALDH1A1SMN1; SMN2HTTTSHRCTSS
SCHEMBL6019478 0.86 CTSS (0.62) CTSSCTSBCTSLCTSK
SCHEMBL6021258 0.85 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2HTTTSHRCTSS
SCHEMBL6019978 0.83 MAPT (0.47) ALDH1A1SMN1; SMN2HTTTSHRCTSS
SCHEMBL6021373 0.82 CTSB (0.57) CTSSCTSBCTSLCTSKMAPT
SCHEMBL6021666 0.81 CTSS (0.58) CTSSCTSBCTSLCTSK
SCHEMBL6020552 0.81 TSHR (0.72) ALDH1A1SMN1; SMN2HTTTSHRCTSS
SCHEMBL6020389 0.80 CTSS (0.60) ALDH1A1CTSSCTSBCTSLCTSK
SCHEMBL6020852 0.79 LMNA (0.57) ALDH1A1SMN1; SMN2HTTTSHRCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US claimed
EP-1575903-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES Jerini AG (DE) 2005-09-21 EP claimed
WO-2004065353-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES JERINI AG (DE) 2004-08-05 WO claimed
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO claimed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP claimed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 EP claimed
US-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 US disclosed
EP-1575903-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES Jerini AG (DE) 2005-09-21 EP disclosed
WO-2004065353-A1 COMPOUNDS FOR THE INHIBITION OF ROTAMASES JERINI AG (DE) 2004-08-05 WO disclosed
WO-2004056755-A2 COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES JERENI AG (DE) 2004-07-08 WO disclosed
EP-1433778-A1 Use of nitriles as rotamase inhibitors Jerini AG (DE) 2004-06-30 EP disclosed
EP-1433779-A1 Use of nitriles as inhibitors of non-proteolytic enzymes Jerini AG (DE) 2004-06-30 EP 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-20060252813-A1 Apparatus for curing a composite laminate DHX29, HDHD5, DHRS9 ALDH1A1 662/4885SMN1; SMN2 3901/4885HTT 2859/4885

“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.