SCHEMBL1551055

SCHEMBL1551055

CS(=O)(=O)N(c1cccc(C(=O)NCc2nc[nH]n2)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 3/20 0.36
CTSD P07339 2/20 0.35
BACE1 P56817 2/20 0.35
BACE2 Q9Y5Z0 2/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 2/20 0.34
HTT P42858 2/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
ALOX12 P18054 1/20 0.34
TP53 P04637 1/20 0.33
CACNA2D1 P54289 1/20 0.33
CACNA1B Q00975 1/20 0.33
CACNB1 Q02641 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
SCHEMBL1997906 0.88 GCGR (0.42)
SCHEMBL1988471 0.87 F2 (0.39) F2SMN1; SMN2MAPTCTSDBACE1
SCHEMBL1989675 0.85 NPC1 (0.37) F2MAPTKMT2ANPC1RAB9A
SCHEMBL3406225 0.84 SCN9A (0.41) SMN1; SMN2MAPTKDM4EMEN1KMT2A
SCHEMBL3408675 0.84 DRD2 (0.40) F2SMN1; SMN2MAPTCTSDBACE1
SCHEMBL979308 0.84 CACNA2D1 (0.41) F2CTSDBACE1BACE2MEN1
Hydrochloric Acid SCHEMBL6519318 0.83 DRD2 (0.39) F2SMN1; SMN2MAPTLMNAKDM4E
SCHEMBL3405538 0.83 CTSD (0.39) F2SMN1; SMN2MAPTCTSDBACE1
SCHEMBL975805 0.83 CACNA2D1 (0.38) F2SMN1; SMN2MAPTCTSDBACE1
SCHEMBL1990889 0.83 NPC1 (0.37) F2SMN1; SMN2MAPTCTSDBACE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110152236-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2011-06-23 US disclosed
EP-2313393-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF Sanofi-Aventis (FR) 2011-04-27 EP disclosed
WO-2010018328-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2010-02-18 WO 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-20110152236-A1 AZETIDINE POLYSUBSTITUTED COMPOUNDS, PREPARATION THEREOF, AND THERAPEUTIC APPLICATION THEREOF C1R, TACR1, C1S F2 1930/4885SMN1; SMN2 2797/4885MAPT 4778/4885

“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.