SCHEMBL976397

SCHEMBL976397

CNC(=O)[C@H](C)NC(=O)c1cc(Cl)cc(NS(=O)(=O)CC2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 4/20 0.34
CCR2 P41597 1/20 0.34
FFAR2 O15552 1/20 0.33
KMT2A Q03164 2/20 0.32
CNR1 P21554 1/20 0.32
MEN1 O00255 1/20 0.32
MCHR1 Q99705 1/20 0.32
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
CACNA1G O43497 1/20 0.31
KCNH2 Q12809 1/20 0.31
CACNA1I Q9P0X4 1/20 0.31
GAA P10253 1/20 0.31
CCKBR P32239 1/20 0.31
WDR5 P61964 1/20 0.31
GPX4 P36969 1/20 0.31

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
SCHEMBL974361 0.93 EPHX2 (0.34) SLC6A9CCR2FFAR2KMT2ACNR1
SCHEMBL977431 0.92 SCN9A (0.38) SLC6A9CCR2FFAR2
SCHEMBL978464 0.92 KMT2A (0.37) SLC6A9CCR2FFAR2KMT2ACNR1
SCHEMBL976400 0.92 CCKBR (0.38) SLC6A9CNR1GRNSORT1CCKBR
SCHEMBL976402 0.92 CCKBR (0.38) SLC6A9CNR1GRNSORT1CCKBR
SCHEMBL976967 0.91 SLC6A9 (0.34) SLC6A9CNR1GRNSORT1KCNH2
SCHEMBL977764 0.90 CCR2 (0.40) CCR2
SCHEMBL974779 0.90 CNR1 (0.35) SLC6A9CCR2CNR1KCNH2GPX4
SCHEMBL976319 0.90 CCR2 (0.42) CCR2
SCHEMBL976507 0.86 CCR1 (0.36) SLC6A9PDE3BPDE3AKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2234966-B1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI SA (FR) 2013-09-11 EP claimed
US-8445478-B2 Azetidine derivatives, their preparation and their application in therapy SANOFI (FR) 2013-05-21 US claimed
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2011-01-13 US claimed
US-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI (FR) 2013-09-12 US disclosed
US-8445478-B2 Azetidine derivatives, their preparation and their application in therapy SANOFI (FR) 2013-05-21 US disclosed
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2011-01-13 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 (2 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-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B SLC6A9 2158/4885CCR2 1287/4885FFAR2 2587/4885
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B SLC6A9 2158/4885CCR2 1287/4885FFAR2 2587/4885

“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.