SCHEMBL3013818

SCHEMBL3013818

O=S(=O)(c1ccc(Br)cc1Cl)C1CCN(c2nc(Cc3ccc(Cl)cc3)cs2)CC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
CTSS P25774 8/20 0.35
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SCN9A Q15858 1/20 0.33
GAA P10253 1/20 0.33
DNM1L O00429 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL3002528 0.94 CTSS (0.35) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3008468 0.93 CTSS (0.35) CTSSRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL3017401 0.93 SMN1; SMN2 (0.35) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3019472 0.93 CTSS (0.36) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3006012 0.92 MAPT (0.39) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3012960 0.92 LMNA (0.36) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3020139 0.91 CTSS (0.36) CTSSRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL3009049 0.91 SOS1 (0.37) MAPTCTSSRAB9ASMN1; SMN2NPC1
SCHEMBL3014810 0.91 CTSS (0.34) CTSSRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL3013907 0.91 CTSS (0.38) CTSSRAB9ASMN1; SMN2NPC1MEN1

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 MAPT 18/4885CTSS 106/4885RAB9A 2943/4885

“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.