SCHEMBL977614

SCHEMBL977614

NC(=O)CCNC(=O)c1cccc(NS(=O)(=O)CC2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)c1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
EPHX2 P34913 2/20 0.38
EGFR P00533 2/20 0.38
FGFR1 P11362 2/20 0.38
KDR P35968 2/20 0.38
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
ALOX5 P09917 1/20 0.36
SCN9A Q15858 2/20 0.36
F10 P00742 1/20 0.35
PRSS1 P07477 1/20 0.35
CCR2 P41597 2/20 0.35
MALT1 Q9UDY8 1/20 0.35
KMT2A Q03164 1/20 0.35
CACNA1G O43497 1/20 0.35

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
SCHEMBL975803 0.91 EGFR (0.39) DRD2DRD3EPHX2EGFRFGFR1
SCHEMBL3408673 0.90 DRD2 (0.40) DRD2DRD3EPHX2EGFRFGFR1
Hydrochloric Acid SCHEMBL6527164 0.90 DRD2 (0.40) DRD2DRD3EPHX2EGFRFGFR1
SCHEMBL3406222 0.88 SCN9A (0.47) DRD2DRD3EPHX2EGFRFGFR1
SCHEMBL979310 0.87 EGFR (0.39) DRD2DRD3EPHX2EGFRFGFR1
SCHEMBL977767 0.85 EGFR (0.39) EGFRFGFR1KDRLMNAF10
SCHEMBL3405536 0.85 PRMT5 (0.41) DRD2DRD3EGFRFGFR1KDR
SCHEMBL3408729 0.84 EGFR (0.40) DRD2DRD3EPHX2EGFRFGFR1
SCHEMBL976516 0.84 EGFR (0.40) EGFRFGFR1KDRF10PRSS1
SCHEMBL3406077 0.84 PRMT5 (0.43) DRD2DRD3EGFRFGFR1KDR

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 11 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
EP-2234966-A2 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY Sanofi-Aventis (FR) 2010-10-06 EP claimed
WO-2009106708-A2 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2009-09-03 WO claimed
US-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI (FR) 2013-09-12 US disclosed
EP-2234966-B1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI SA (FR) 2013-09-11 EP 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
EP-2234966-A2 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY Sanofi-Aventis (FR) 2010-10-06 EP disclosed
WO-2009106708-A2 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2009-09-03 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 (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 DRD2 19/4885DRD3 103/4885EPHX2 968/4885
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B DRD2 19/4885DRD3 103/4885EPHX2 968/4885

“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.