SCHEMBL3016938

SCHEMBL3016938

O=[N+]([O-])c1cccc(S(=O)(=O)C2CCN(c3nc(Cc4ccc(F)c(Cl)c4)cs3)CC2)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
PKM P14618 1/20 0.34
PKLR P30613 1/20 0.34
CXCR3 P49682 1/20 0.33
DNM1L O00429 1/20 0.33

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
SCHEMBL3019919 0.94 LMNA (0.36) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3015086 0.93 LMNA (0.37) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3019115 0.93 SMN1; SMN2 (0.37) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3019649 0.92 MAPT (0.40) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL3013737 0.91 KDM1A (0.42) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3010254 0.90 KDM1A (0.39) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3017451 0.89 RAB9A (0.38) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL3009255 0.89 HTR2A (0.37) ALDH1A1MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL3011541 0.89 KDM1A (0.36) KDM1ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL3013944 0.89 VCAM1 (0.37) LMNAALDH1A1MAPTHTT

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 KDM1A 3548/4885LMNA 80/4885ALDH1A1 3510/4885

“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.