SCHEMBL3006944

SCHEMBL3006944

Cc1ccc(C)c(Cc2csc(N3CCC(S(=O)(=O)c4ccc(Br)cc4Cl)CC3)n2)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
AR P10275 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
CTSS P25774 6/20 0.33
DNM1L O00429 3/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
EPHX2 P34913 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL3010811 0.92 EPHX2 (0.37) LMNATP53MAPTARCTSS
SCHEMBL3019117 0.91 CTSS (0.35) LMNAHCRTR1HCRTR2CTSSDNM1L
SCHEMBL3019762 0.90 CTSS (0.43) LMNATP53MAPTARCTSS
SCHEMBL3017318 0.89 MAPT (0.35) LMNATP53MAPTARDNM1L
SCHEMBL3003909 0.89 CTSS (0.40) LMNATP53MAPTARCTSS
SCHEMBL3017401 0.89 SMN1; SMN2 (0.35) MAPTHCRTR1HCRTR2CTSSDNM1L
SCHEMBL3011768 0.88 HCRTR1 (0.36) HCRTR1HCRTR2CTSSDNM1LNPC1
SCHEMBL3004085 0.87 CTSS (0.35) LMNAMAPTHCRTR1HCRTR2CTSS
SCHEMBL3003832 0.87 CTSS (0.33) HCRTR1HCRTR2CTSSDNM1LCNR1
SCHEMBL3022709 0.87 ALDH1A1 (0.39) MAPTCNR1CNR2RAB9ASMN1; 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 LMNA 80/4885TP53 2880/4885MAPT 18/4885

“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.