SCHEMBL3017076

SCHEMBL3017076

O=S(=O)(c1cc(Cl)cc(Cl)c1)C1CCN(c2nc(-c3ccc(F)c(F)c3)cs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.48
SMN1; SMN2 Q16637 10/20 0.48
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 2/20 0.47
NPC1 O15118 10/20 0.46
MAPK1 P28482 3/20 0.45
AR P10275 3/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
USP2 O75604 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL3006108 0.94 SMN1; SMN2 (0.47) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3003712 0.93 SMN1; SMN2 (0.48) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3019458 0.93 SMN1; SMN2 (0.48) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3016865 0.92 SMN1; SMN2 (0.54) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3003230 0.91 SMN1; SMN2 (0.49) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3009658 0.90 AR (0.51) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3006219 0.90 SMN1; SMN2 (0.57) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3017336 0.89 SMN1; SMN2 (0.56) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3018144 0.89 SMN1; SMN2 (0.53) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1
SCHEMBL3007802 0.88 AR (0.58) RAB9ASMN1; SMN2L3MBTL1ALDH1A1NPC1

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 RAB9A 2943/4885SMN1; SMN2 1/4885L3MBTL1 1847/4885

“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.