SCHEMBL3015692

SCHEMBL3015692

COc1ccc(-c2csc(N3CCC(S(=O)(=O)c4c(C)cc(C)cc4C)CC3)n2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.48
CYP1A1 P04798 2/20 0.46
CYP1B1 Q16678 2/20 0.46
RAB9A P51151 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
REV1 Q9UBZ9 1/20 0.43
MAPT P10636 9/20 0.42
NPC1 O15118 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
ATM Q13315 1/20 0.41
LMNA P02545 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39

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
SCHEMBL3013524 0.93 REV1 (0.51) ARRAB9ASMN1; SMN2REV1MAPT
SCHEMBL3008955 0.91 AR (0.48) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3015281 0.89 AR (0.48) ARRAB9ASMN1; SMN2REV1MAPT
SCHEMBL3017580 0.88 AR (0.49) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3017832 0.88 AR (0.54) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3022472 0.87 AR (0.52) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3015749 0.87 SMN1; SMN2 (0.58) ARRAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3020219 0.87 AR (0.52) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3016298 0.86 AR (0.52) ARCYP1A1CYP1B1RAB9ASMN1; SMN2
SCHEMBL3006321 0.86 AR (0.51) ARCYP1A1CYP1B1RAB9ASMN1; SMN2

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 AR 3801/4885CYP1A1 4605/4885CYP1B1 4305/4885

“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.