SCHEMBL3006940

SCHEMBL3006940

O=S(=O)(c1ccc(Cl)cc1)C1CCN(c2nc(-c3ccc(Cl)cc3)cs2)CC1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.58
RAB9A P51151 7/20 0.58
NPC1 O15118 6/20 0.58
MAPK1 P28482 4/20 0.58
MAPT P10636 6/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
LMNA P02545 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.52
ALDH1A1 P00352 2/20 0.52
TSHR P16473 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
FFAR2 O15552 1/20 0.48
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL3001102 0.94 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3014611 0.94 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3001913 0.94 SMN1; SMN2 (0.61) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3003995 0.94 SMN1; SMN2 (0.57) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3012045 0.94 RAB9A (0.58) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3017336 0.93 SMN1; SMN2 (0.56) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3013329 0.93 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3002010 0.92 MAPT (0.53) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3016686 0.92 RAB9A (0.59) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL3020027 0.92 MAPT (0.69) SMN1; SMN2RAB9ANPC1MAPK1MAPT

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.