SCHEMBL3013341

SCHEMBL3013341

CC(C)c1cc(C(C)C)c(S(=O)(=O)C2CCN(c3nc(-c4cccc(Br)c4)cs3)CC2)c(C(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.44
RAB9A P51151 7/20 0.44
NPC1 O15118 5/20 0.44
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 3/20 0.41
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
CDC25A P30304 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
MAPT P10636 4/20 0.39
HSD17B10 Q99714 2/20 0.39
USP2 O75604 1/20 0.39
RECQL P46063 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 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
SCHEMBL3002615 0.90 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3019653 0.90 MAPK1 (0.52) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3014196 0.88 MAPT (0.53) SMN1; SMN2MEN1KMT2ALMNAMAPK1
SCHEMBL3012592 0.85 SMN1; SMN2 (0.42) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3003952 0.85 MAPT (0.49) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3017646 0.85 SMN1; SMN2 (0.53) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3008973 0.85 FABP4 (0.38) KMT2ALMNAALDH1A1TSHRFABP4
SCHEMBL3017982 0.85 AR (0.51) SMN1; SMN2RAB9ANPC1LMNAMAPK1
SCHEMBL3012873 0.85 MAPK1 (0.42) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL3015831 0.84 SMN1; SMN2 (0.39) SMN1; SMN2RAB9ANPC1MEN1KMT2A

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 SMN1; SMN2 1/4885RAB9A 2943/4885NPC1 15/4885

“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.