SCHEMBL3010123

SCHEMBL3010123

O=S(=O)(c1ccccc1C(F)(F)F)C1CCN(c2nc(-c3ccc(F)c(Cl)c3)cs2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.45
KDM1A O60341 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
RAB9A P51151 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
AR P10275 2/20 0.42
NPC1 O15118 3/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
SCHEMBL3016817 0.93 CTSS (0.45) CTSSKDM1ASMN1; SMN2MAPTALDH1A1
SCHEMBL3008583 0.93 AR (0.51) CTSSKDM1ASMN1; SMN2MAPTALDH1A1
SCHEMBL3013619 0.92 CTSS (0.47) CTSSKDM1ASMN1; SMN2MAPTALDH1A1
SCHEMBL3006363 0.90 SMN1; SMN2 (0.49) CTSSSMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL3006941 0.90 KDM1A (0.55) CTSSKDM1ASMN1; SMN2MAPTALDH1A1
SCHEMBL3015543 0.90 CTSS (0.48) CTSSKDM1ASMN1; SMN2MAPTMEN1
SCHEMBL3008706 0.88 CTSS (0.45) CTSSKDM1ASMN1; SMN2MAPTALDH1A1
SCHEMBL3002722 0.88 SMN1; SMN2 (0.45) SMN1; SMN2MAPTALDH1A1MEN1LMNA
SCHEMBL3012646 0.86 SMN1; SMN2 (0.50) CTSSSMN1; SMN2MAPTALDH1A1MEN1
SCHEMBL3006305 0.86 KMT2A (0.57) KDM1ASMN1; SMN2MAPTALDH1A1MEN1

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 CTSS 106/4885KDM1A 3548/4885SMN1; SMN2 1/4885

“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.