SCHEMBL3014355

SCHEMBL3014355

COc1ccccc1Cc1csc(N2CCC(S(=O)(=O)c3ccc(Br)cc3Cl)CC2)n1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.37
DRD4 P21917 5/20 0.37
DRD3 P35462 5/20 0.37
PSMD14 O00487 2/20 0.35
CTSS P25774 6/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PPARG P37231 1/20 0.34
GFER P55789 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ERBB2 P04626 4/20 0.33
EPHA2 P29317 4/20 0.33
KDR P35968 3/20 0.33
EPHB4 P54760 3/20 0.33
TP53 P04637 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
SCHEMBL3012653 0.93 MEN1 (0.37) DRD2CTSSMAPTALDH1A1TP53
SCHEMBL3015119 0.91 CTSS (0.44) CTSSMAPTLMNATP53
SCHEMBL3015530 0.91 DRD2 (0.40) DRD2DRD4DRD3MAPTALDH1A1
SCHEMBL15671698 0.90 MAPT (0.36) DRD2DRD4DRD3CTSSMAPT
SCHEMBL3001183 0.90 RAB9A (0.35) DRD2DRD4DRD3CTSSMAPT
SCHEMBL3018577 0.90 CTSS (0.40) CTSSMAPTALDH1A1LMNATP53
SCHEMBL3019117 0.89 CTSS (0.35) CTSSLMNA
SCHEMBL3013781 0.88 TP53 (0.36) MAPTALDH1A1LMNATP53
SCHEMBL3002832 0.87 TP53 (0.38) DRD2MAPTALDH1A1LMNATP53
SCHEMBL3006531 0.87 TP53 (0.41) DRD2DRD4DRD3MAPTALDH1A1

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 DRD2 573/4885DRD4 1124/4885DRD3 682/4885

“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.