SCHEMBL3016036

SCHEMBL3016036

CCCc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4cccc(Cl)c4)CC3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.36
HTR6 P50406 1/20 0.36
HTR2A P28223 3/20 0.35
KCNH2 Q12809 2/20 0.35
HTR2C P28335 1/20 0.35
DRD2 P14416 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.34
GRM5 P41594 1/20 0.33
CTPS1 P17812 1/20 0.33
MAPT P10636 1/20 0.33
HSD11B1 P28845 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL3264261 0.93 RAB9A (0.39) RAB9ASMN1; SMN2POLBHTR6HTR2A
SCHEMBL3012962 0.93 AOC3 (0.34) RAB9ASMN1; SMN2HTR2AKCNH2HTR2C
SCHEMBL3003047 0.92 RAB9A (0.41) RAB9ASMN1; SMN2POLBHTR6HTR2A
SCHEMBL3013025 0.91 SMN1; SMN2 (0.39) RAB9ASMN1; SMN2POLBHTR6HTR2A
SCHEMBL3013512 0.90 HTR2A (0.44) RAB9ASMN1; SMN2HTR2AKCNH2HTR2C
SCHEMBL3016805 0.89 HTR2A (0.35) RAB9AHTR2AKCNH2HTR2CDRD2
SCHEMBL3008077 0.89 GPR6 (0.41) RAB9APOLBHTR2AKCNH2HTR2C
SCHEMBL3016706 0.89 MAPT (0.37) SMN1; SMN2HTR2AKCNH2HTR2CDRD2
SCHEMBL3013306 0.89 RAB9A (0.42) RAB9ASMN1; SMN2POLBHTR6HTR2A
SCHEMBL3006480 0.89 LMNA (0.41) RAB9ASMN1; SMN2MAPTNPC1

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 RAB9A 2943/4885SMN1; SMN2 1/4885POLB 4649/4885

“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.