SCHEMBL47012

SCHEMBL47012

CCN(CC)c1ccc(NC(=O)c2cccc(C(=O)N(C)CCN3CCC[C@H]3C(=O)NCCOCCOCCOCCOCCOCCOCCOCCOC)c2)c(-c2cc(C(N)=O)ccn2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC34A2 O95436 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EPHX2 P34913 1/20 0.33
GFER P55789 3/20 0.32
CYP2C19 P33261 2/20 0.32
CYP1A2 P05177 1/20 0.32
CARM1 Q86X55 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32
CCR5 P51681 2/20 0.32
IRAK4 Q9NWZ3 2/20 0.32
NPSR1 Q6W5P4 1/20 0.31
HTR3A P46098 1/20 0.31
SMYD2 Q9NRG4 1/20 0.31
ABCB1 P08183 2/20 0.30
KCNH2 Q12809 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
SCHEMBL10274107 0.91 SLC34A2 (0.34) SLC34A2SMN1; SMN2EPHX2CARM1ALDH1A1
SCHEMBL18482259 0.89 SLC34A2 (0.57) SLC34A2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL6000768 0.89 SLC34A2 (0.57) SLC34A2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL15432833 0.89 SLC34A2 (0.38) SLC34A2SMN1; SMN2LMNACYP2C19CYP1A2
SCHEMBL10290366 0.89 SLC34A2 (0.38) SLC34A2SMN1; SMN2LMNACYP2C19CYP1A2
SCHEMBL6001480 0.87 SLC34A2 (0.57) SLC34A2SMN1; SMN2ALDH1A1HRH3KDM4E
SCHEMBL15420880 0.87 SLC34A2 (0.57) SLC34A2SMN1; SMN2ALDH1A1HRH3KDM4E
SCHEMBL18482731 0.86 SLC34A2 (0.39) SLC34A2SMN1; SMN2EPHX2ALDH1A1IRAK4
SCHEMBL10274775 0.83 SLC34A2 (0.34) SLC34A2EPHX2HRH3
SCHEMBL10274263 0.82 IRAK4 (0.33) SLC34A2SMN1; SMN2MAPTLMNAEPHX2

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-20170037010-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2017-02-09 US disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 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 (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-20170037010-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A2, SLC34A1, SLC10A2 SLC34A2 1/4885SMN1; SMN2 4868/4885MAPT 3957/4885

“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.