SCHEMBL979322

SCHEMBL979322

COC(=O)c1cc(F)cc(NS(=O)(=O)CC2CN(C(c3ccc(C)cc3)c3ccc(C)cc3)C2)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TCF4 P15884 1/20 0.37
CTNNB1 P35222 1/20 0.37
GAA P10253 1/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 3/20 0.35
SCN9A Q15858 3/20 0.35
HPGD P15428 1/20 0.35
OPRD1 P41143 3/20 0.34
SCN7A Q01118 1/20 0.34
SCN5A Q14524 1/20 0.34
GRIA2 P42262 1/20 0.34
MGLL Q99685 1/20 0.33
SLC6A9 P48067 1/20 0.33
CYP2C9 P11712 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32
FABP4 P15090 1/20 0.32

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
SCHEMBL975372 0.94 KDM4E (0.41) LMNAMEN1KMT2AKDM4ESCN9A
SCHEMBL977022 0.92 SLC6A9 (0.37) LMNAMEN1KMT2AKDM4ESCN9A
SCHEMBL978278 0.90 FABP4 (0.37) LMNASCN9ASCN7ASCN5AGRIA2
SCHEMBL977906 0.89 ACHE (0.42) LMNAMEN1KMT2ASCN9AOPRD1
SCHEMBL974855 0.87 HPGD (0.38) LMNAMEN1KMT2ASCN9AHPGD
SCHEMBL977039 0.85 NHERF1 (0.40) GAALMNAMEN1KMT2ASCN9A
SCHEMBL978430 0.85 HPGD (0.38) GAALMNASCN9AHPGDOPRD1
SCHEMBL977371 0.84 FABP4 (0.41) GAALMNAMEN1KMT2ASCN9A
SCHEMBL976538 0.84 BCHE (0.38) LMNASCN9AHPGDOPRD1SLC6A9
SCHEMBL977049 0.83 SCN9A (0.39) KDM4ESCN9AHPGDSCN5ACYP2C9

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
US-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI (FR) 2013-09-12 US claimed
EP-2234966-B1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI SA (FR) 2013-09-11 EP 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 TCF4 3450/4885CTNNB1 3720/4885GAA 728/4885
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B TCF4 3450/4885CTNNB1 3720/4885GAA 728/4885

“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.