SCHEMBL3016099

SCHEMBL3016099

O=S(=O)(c1ccccc1Cl)C1CCN(c2nc(Cc3ccc(Cl)cc3Cl)cs2)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.42
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
EPHX2 P34913 4/20 0.38
GAA P10253 1/20 0.37
AR P10275 1/20 0.36
RECQL P46063 1/20 0.35
MAPT P10636 3/20 0.35
ACLY P53396 1/20 0.35
FFAR2 O15552 1/20 0.35
NPC1 O15118 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL3006778 0.93 GAA (0.39) CTSSRAB9ASMN1; SMN2EPHX2GAA
SCHEMBL3013659 0.93 CTSS (0.42) CTSSRAB9ASMN1; SMN2EPHX2GAA
SCHEMBL3000548 0.92 GAA (0.38) RAB9ASMN1; SMN2EPHX2GAAAR
SCHEMBL3017329 0.92 EPHX2 (0.44) CTSSRAB9ASMN1; SMN2EPHX2GAA
SCHEMBL3012602 0.89 HTR2A (0.45) CTSSRAB9ASMN1; SMN2EPHX2GAA
SCHEMBL3011203 0.89 CTSS (0.43) CTSSEPHX2
SCHEMBL3019999 0.88 CTSS (0.43) CTSSRAB9ASMN1; SMN2EPHX2MAPT
SCHEMBL2997798 0.88 CTSS (0.43) CTSSRAB9ASMN1; SMN2EPHX2GAA
SCHEMBL3014906 0.88 CTSS (0.45) CTSSSMN1; SMN2EPHX2GAAAR
SCHEMBL3001996 0.88 GRM2 (0.37) CTSSRAB9ASMN1; SMN2EPHX2GAA

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 106/4885RAB9A 2943/4885SMN1; SMN2 1/4885

“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.