SCHEMBL3015244

SCHEMBL3015244

O=S(=O)(c1c(F)c(Br)cc(F)c1Br)C1CCN(c2nc(-c3cc(F)cc(F)c3)cs2)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.41
RAB9A P51151 8/20 0.41
NPC1 O15118 7/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
MAPK1 P28482 3/20 0.40
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
AR P10275 2/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 2/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL3008656 0.94 SMN1; SMN2 (0.40) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3016675 0.90 MEN1 (0.47) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3015261 0.89 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3015293 0.88 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3013115 0.88 SMN1; SMN2 (0.46) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3014886 0.87 SMN1; SMN2 (0.42) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3014203 0.87 MAPK1 (0.51) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3017610 0.86 AR (0.42) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3002817 0.86 AR (0.42) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1
SCHEMBL3016018 0.86 SMN1; SMN2 (0.47) SMN1; SMN2RAB9ANPC1L3MBTL1MAPK1

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 SMN1; SMN2 1/4885RAB9A 2943/4885NPC1 15/4885

“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.