SCHEMBL14601702

SCHEMBL14601702

O=C(NCc1cccc(C(F)(F)F)c1)c1cc(Br)ccc1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 2/20 0.56
KDM1A O60341 1/20 0.50
MAPT P10636 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
KCNA5 P22460 1/20 0.48
LMNA P02545 3/20 0.47
RAB9A P51151 1/20 0.47
MAPK14 Q16539 1/20 0.46
HPGD P15428 1/20 0.45
SLC20A2 Q08357 1/20 0.44
SLC20A1 Q8WUM9 1/20 0.44
NAMPT P43490 1/20 0.44
KDM4E B2RXH2 1/20 0.44
SCN3A Q9NY46 1/20 0.43
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
MLYCD O95822 1/20 0.43

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
SCHEMBL5598059 0.85 CCR9 (0.62) CCR9KDM1AMAPTMEN1KMT2A
SCHEMBL5597986 0.85 CCR9 (0.58) CCR9KDM1AMEN1KMT2AKCNA5
SCHEMBL5598199 0.81 CCR9 (0.58) CCR9KDM1A
SCHEMBL5597849 0.80 CCR9 (0.55) CCR9MAPTMEN1KMT2AHTT
SCHEMBL14601699 0.80 CCR9 (0.63) CCR9KDM1ASLC20A2SLC20A1
SCHEMBL5597820 0.78 CCR9 (0.72) CCR9KDM1A
SCHEMBL5597922 0.78 CCR9 (0.56) CCR9KDM1AMEN1KMT2ANPSR1
SCHEMBL3243266 0.77 CCR9 (0.70) CCR9KDM1ALMNA
SCHEMBL5597824 0.77 CCR9 (0.70) CCR9KDM1A
SCHEMBL14458165 0.75 CCR9 (0.54) CCR9NPSR1LMNAHPGDKDM4E

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-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 US disclosed
US-20070021509-A1 Phosphate transport inhibitors JOZEFIAK THOMAS H 2007-01-25 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-20070021509-A1 Phosphate transport inhibitors SLC34A2, SLC34A1, SLC20A1 CCR9 4370/4885KDM1A 4140/4885MAPT 3058/4885

“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.