SCHEMBL3014977

SCHEMBL3014977

CCOc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4cccc(Cl)c4Cl)CC3)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 5/20 0.42
CNR2 P34972 3/20 0.38
PTGER1 P34995 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 6/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
AURKA O14965 1/20 0.34
AURKB Q96GD4 1/20 0.34
INCENP Q9NQS7 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL3006934 0.93 CTSS (0.42) CTSSCNR2NPSR1MAPTSMN1; SMN2
SCHEMBL3010412 0.91 CTSS (0.41) CTSSPTGER1MAPTSMN1; SMN2NPC1
SCHEMBL3016558 0.90 CTSS (0.42) CTSSSMN1; SMN2RAB9AAURKAAURKB
SCHEMBL3018021 0.89 CTSS (0.41) CTSSSMN1; SMN2RAB9AAURKAAURKB
SCHEMBL3018933 0.89 CTSS (0.42) CTSSSMN1; SMN2NPC1RAB9AAURKA
SCHEMBL3005413 0.89 CTSS (0.44) CTSSMAPTSMN1; SMN2NPC1RAB9A
SCHEMBL2998477 0.88 CTSS (0.44) CTSSSMN1; SMN2NPC1RAB9AAURKA
SCHEMBL3008961 0.87 TDP1 (0.41) PTGER1MAPTSMN1; SMN2KDM4E
SCHEMBL3004540 0.86 CNR2 (0.40) CNR2NPSR1MAPTSMN1; SMN2KDM4E
SCHEMBL3009850 0.86 CNR2 (0.41) CTSSCNR2MAPTSMN1; SMN2KDM4E

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 106/4885CNR2 2911/4885PTGER1 3900/4885

“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.