SCHEMBL3000576

SCHEMBL3000576

O=S(=O)(c1ccc(Br)cc1Cl)C1CCN(c2nc(-c3ccc(Cl)c(Cl)c3)cs2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.53
SMN1; SMN2 Q16637 12/20 0.48
RAB9A P51151 11/20 0.48
NPC1 O15118 9/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44
CDC25A P30304 1/20 0.44
MAPT P10636 3/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
HPGD P15428 1/20 0.42
CYP3A4 P08684 1/20 0.41
ABL1 P00519 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL3014130 0.92 SMN1; SMN2 (0.48) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3021574 0.92 SMN1; SMN2 (0.46) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3020022 0.91 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3011005 0.90 SMN1; SMN2 (0.49) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3017665 0.90 RAB9A (0.47) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3010708 0.90 AR (0.55) ARSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL3014500 0.90 SMN1; SMN2 (0.48) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3017053 0.90 SMN1; SMN2 (0.46) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3019613 0.90 SMN1; SMN2 (0.52) ARSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3005743 0.89 RAB9A (0.50) ARSMN1; SMN2RAB9ANPC1MEN1

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 AR 3801/4885SMN1; SMN2 1/4885RAB9A 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.