SCHEMBL16804658

SCHEMBL16804658

CCOCCOCCOCCOCCCCOCCOCCOCCOCCCc1cccc(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.51
CYP4F2 P78329 4/20 0.51
CYP4A11 Q02928 4/20 0.51
TP53 P04637 2/20 0.51
PKM P14618 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
FOLH1 Q04609 1/20 0.47
PLA2G4B P0C869 1/20 0.46
KMT2A Q03164 1/20 0.46
RAB9A P51151 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HRH2 P25021 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44

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
SCHEMBL16804661 0.91 PLA2G4B (0.55) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL40246 0.89 CYP4F2 (0.49) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL25284732 0.88 MRGPRX4 (0.56) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL40891 0.85 MRGPRX4 (0.43) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL15444416 0.85 KDM4E (0.48) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL27487853 0.83 CYP4F2 (0.47) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL27865824 0.82 CYP4F2 (0.57) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL40890 0.81 MRGPRX4 (0.43) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL40158 0.81 CYP4F2 (0.41) MRGPRX4CYP4F2CYP4A11TP53PKM
SCHEMBL40210 0.81 CYP4F2 (0.41) MRGPRX4CYP4F2CYP4A11TP53PKM

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-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2015-06-18 US disclosed
US-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. 2015-06-18 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-20150164876-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT SLC34A2, SLC34A1, SLC10A2 MRGPRX4 947/4885CYP4F2 316/4885CYP4A11 527/4885

“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.