SCHEMBL3007744

SCHEMBL3007744

Cc1cc(C)cc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(F)cc4Cl)CC3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.45
NAAA Q02083 4/20 0.35
MAPK1 P28482 1/20 0.34
GPR6 P46095 1/20 0.34
DNM1L O00429 3/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL3018853 0.93 CTSS (0.45) CTSSNAAAMAPK1GPR6HRH3
SCHEMBL3004707 0.92 CTSS (0.47) CTSSNAAAGPR6DNM1LALDH1A1
SCHEMBL3013842 0.92 CTSS (0.47) CTSSNAAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL3007308 0.92 CTSS (0.47) CTSSNAAAMAPK1HRH3ALDH1A1
SCHEMBL3018534 0.91 GAA (0.36) CTSSDNM1LSMN1; SMN2
SCHEMBL3010134 0.91 GPR6 (0.39) CTSSNAAAMAPK1GPR6DNM1L
SCHEMBL3012281 0.90 CTSS (0.44) CTSSNAAAMAPK1GPR6DNM1L
SCHEMBL3016624 0.90 CTSS (0.43) CTSSNAAAMAPK1GPR6HRH3
SCHEMBL3011818 0.89 CTSS (0.46) CTSSNAAAMAPK1HRH3ALDH1A1
SCHEMBL3015154 0.89 HCRTR1 (0.38) CTSSDNM1LSMN1; SMN2

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-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA CTSS 106/4885NAAA 3229/4885MAPK1 2767/4885

“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.