SCHEMBL3014077

SCHEMBL3014077

O=S(=O)(c1c(F)c(Br)cc(F)c1Br)C1CCN(c2nc(Cc3ccc(F)c(Cl)c3)cs2)CC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 6/20 0.33
MAPT P10636 1/20 0.32
GAA P10253 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL3006028 0.95 LMNA (0.34) NPC1RAB9ASMN1; SMN2
SCHEMBL3016904 0.93 PROKR1 (0.33) NPC1RAB9ASMN1; SMN2
SCHEMBL3012451 0.93 MAPT (0.34) MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3008790 0.92 CACNA1G (0.33) MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3019946 0.91 NPC1 (0.30) NPC1RAB9ASMN1; SMN2
SCHEMBL3017002 0.89 MAPT (0.35) SOS1MAPTGAANPC1RAB9A
SCHEMBL3001149 0.88 EPHX2 (0.36) MAPTGAANPC1RAB9ASMN1; SMN2
SCHEMBL3012892 0.88 DNM1L (0.32) NPC1RAB9ASMN1; SMN2
SCHEMBL3020762 0.88
SCHEMBL3003296 0.88 DNM1L (0.34) MAPTNPC1RAB9ASMN1; 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 SOS1 715/4885MAPT 18/4885GAA 110/4885

“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.