SCHEMBL6525306

SCHEMBL6525306

CS(=O)(=O)N(c1cc(F)cc(C(=O)NC2(CO)CC2)c1)C1CN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)C1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.35
DGAT2 Q96PD7 4/20 0.34
SLC6A9 P48067 1/20 0.32
DDR1 Q08345 1/20 0.31
BDKRB1 P46663 1/20 0.31
CACNA2D1 P54289 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNB1 Q02641 1/20 0.31
CACNA1C Q13936 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
TBXA2R P21731 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
CCR5 P51681 1/20 0.30
GRIA2 P42262 1/20 0.30
TP53 P04637 1/20 0.30
BACE1 P56817 2/20 0.30
CACNA1H O95180 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL6523366 0.94 F2 (0.34) F2SLC6A9DDR1BDKRB1CACNA2D1
SCHEMBL3405557 0.88 UTS2R (0.35) F2SLC6A9CACNA2D1CACNA1BCACNB1
SCHEMBL6521493 0.87 F2 (0.37) F2SLC6A9DDR1HRH3GRIA2
SCHEMBL3409864 0.86 F2 (0.38) F2SLC6A9DDR1HRH3GRIA2
SCHEMBL3405699 0.86 BACE1 (0.41) F2SLC6A9HRH3BACE1
SCHEMBL3404007 0.85 ACKR3 (0.37) F2DGAT2CACNA2D1CACNA1BCACNB1
SCHEMBL3401743 0.85 BACE1 (0.37) F2DGAT2BACE1
SCHEMBL3403098 0.84 BACE1 (0.36) F2DGAT2SLC6A9DDR1CACNA2D1
SCHEMBL3408137 0.84 DDR1 (0.36) F2DDR1BDKRB1
SCHEMBL3403100 0.84 BACE1 (0.38) F2DDR1TP53BACE1CACNA1H

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-20110053908-A1 AZETIDINE-DERIVED COMPOUNDS, PREPARATION METHOD THEREFOR AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-03-03 US claimed
US-20110053908-A1 AZETIDINE-DERIVED COMPOUNDS, PREPARATION METHOD THEREFOR AND THERAPEUTIC USE OF SAME SANOFI-AVENTIS (FR) 2011-03-03 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-20110053908-A1 AZETIDINE-DERIVED COMPOUNDS, PREPARATION METHOD THEREFOR AND THERAPEUTIC USE OF SAME QDPR, NHERF1, GABRR1 F2 1098/4885DGAT2 3208/4885SLC6A9 379/4885

“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.