SCHEMBL3006262

SCHEMBL3006262

COc1ccc(OC)c(Cc2csc(N3CCC(S(=O)(=O)c4ccccc4C(F)(F)F)CC3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.42
RXFP1 Q9HBX9 1/20 0.40
KCNQ1 P51787 1/20 0.39
SCD O00767 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
ADRB2 P07550 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL3005445 0.94 CTSS (0.42) CTSSRXFP1KCNQ1SCDMEN1
SCHEMBL3018643 0.91 CTSS (0.43) CTSSSCDL3MBTL1
SCHEMBL3003638 0.88 CTSS (0.40) CTSSRXFP1KCNQ1L3MBTL1MAPT
SCHEMBL3016871 0.88 MAPT (0.37) CTSSRXFP1L3MBTL1MAPTLMNA
SCHEMBL3008339 0.88 CTSS (0.45) CTSSKCNQ1SCDMAPT
SCHEMBL3014447 0.87 ALDH1A1 (0.43) KMT2AL3MBTL1MAPTLMNAPOLB
SCHEMBL3002244 0.87 CTSS (0.42) CTSSKCNQ1SCDL3MBTL1MAPT
SCHEMBL3012274 0.87 CTSS (0.43) CTSSKCNQ1SCDMEN1KMT2A
SCHEMBL3002344 0.87 ALDH1A1 (0.47) KCNQ1MEN1KMT2AL3MBTL1MAPT
SCHEMBL3010917 0.87 CTSS (0.43) CTSSKCNQ1SCDL3MBTL1MAPT

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 106/4885RXFP1 3775/4885KCNQ1 2702/4885

“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.