SCHEMBL3012879

SCHEMBL3012879

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

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.46
RAB9A P51151 6/20 0.46
AR P10275 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 5/20 0.43
MAPK1 P28482 3/20 0.43
MAPT P10636 4/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CTSS P25774 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
ABL1 P00519 1/20 0.39
FFAR2 O15552 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
SCHEMBL3011081 0.95 SMN1; SMN2 (0.47) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3018634 0.93 SMN1; SMN2 (0.47) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3008815 0.93 CTSS (0.49) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3010708 0.91 AR (0.55) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3014130 0.91 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3002467 0.90 SMN1; SMN2 (0.53) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3015307 0.90 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3019160 0.90 SMN1; SMN2 (0.47) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1
SCHEMBL3013979 0.89 RAB9A (0.46) SMN1; SMN2RAB9AARNPC1MAPK1
SCHEMBL3017539 0.89 CTSS (0.49) SMN1; SMN2RAB9AARL3MBTL1ALDH1A1

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 2943/4885AR 3801/4885

“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.