SCHEMBL3014690

SCHEMBL3014690

COc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(C(C)(C)C)cc4)CC3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.41
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
AVPR1B P47901 8/20 0.39
OXTR P30559 6/20 0.39
AVPR1A P37288 6/20 0.39
MAPT P10636 1/20 0.38
MMP13 P45452 2/20 0.37
MMP1 P03956 1/20 0.37
MMP8 P22894 1/20 0.37
NR3C1 P04150 2/20 0.36
PTGER2 P43116 2/20 0.36
NPC1 O15118 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
SCHEMBL3009878 0.92 HSD11B1 (0.36) HSD11B1RAB9ASMN1; SMN2MAPTNR3C1
SCHEMBL3000391 0.91 KMT2A (0.37) HSD11B1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3014356 0.90 RAB9A (0.41) RAB9ASMN1; SMN2AVPR1BOXTRAVPR1A
SCHEMBL3002256 0.90 ACHE (0.34) HSD11B1SMN1; SMN2
SCHEMBL3014372 0.90 GBA1 (0.41) HSD11B1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3006084 0.90 PTPRB (0.41) HSD11B1SMN1; SMN2MAPTNR3C1
SCHEMBL3011697 0.89 HSD11B1 (0.39) HSD11B1SMN1; SMN2MAPTPTGER2
SCHEMBL3006471 0.89 RAB9A (0.41) RAB9ASMN1; SMN2AVPR1BOXTRAVPR1A
SCHEMBL3017174 0.89 RAB9A (0.41) RAB9ASMN1; SMN2AVPR1BOXTRAVPR1A
SCHEMBL3016039 0.89 MAPT (0.46) RAB9ASMN1; SMN2AVPR1BOXTRAVPR1A

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 HSD11B1 1034/4885RAB9A 2943/4885SMN1; 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.