SCHEMBL2863706

SCHEMBL2863706

CCOc1ccc(Cc2cc(CP(=O)(O)O)ccc2O)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 4/20 0.49
SLC5A2 P31639 4/20 0.49
THRA P10827 6/20 0.48
THRB P10828 6/20 0.48
PTPN1 P18031 1/20 0.44
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PLK1 P53350 1/20 0.40
DHFR P00374 1/20 0.40

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
SCHEMBL2874053 0.90 THRA (0.52) SLC5A1SLC5A2THRATHRBPTPN1
SCHEMBL2866968 0.87 THRA (0.47) SLC5A1SLC5A2THRATHRBALDH1A1
SCHEMBL27684412 0.87 SLC5A2 (0.47) SLC5A1SLC5A2THRATHRBALDH1A1
SCHEMBL2874055 0.85 SLC5A2 (0.51) SLC5A1SLC5A2
SCHEMBL2865173 0.85 SLC5A1 (0.50) SLC5A1SLC5A2THRATHRBPTPN1
SCHEMBL2869183 0.84 THRA (0.47) THRATHRBALDH1A1MAPTKDM4E
SCHEMBL2863741 0.81 ALDH1A1 (0.45) SLC5A1SLC5A2THRATHRBPTPN1
SCHEMBL2872112 0.81 ESR1 (0.42) SLC5A1SLC5A2PTPN1KDM4EPLK1
SCHEMBL2873185 0.81 THRA (0.45) SLC5A1SLC5A2THRATHRBPTPN1
SCHEMBL16301967 0.81 NQO1 (0.54) PTPN1ALDH1A1MAPTKDM4EPLK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691898-B2 Phosphonic acid derivatives and the treating agents of diseases related hyperphosphatemia KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2010-04-06 US disclosed
US-20080119441-A1 Phosphonic Acid Derivatives and the Treating Agents of Diseases Related Hyperphosphatemia KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2008-05-22 US disclosed
CN-101072783-A Phosphonic acid derivative and therapeutic agent for disease in which high phosphate level in blood participates KOTOBUKI PHARMACEUTICAL CO LTD (JP) 2007-11-14 CN 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-20080119441-A1 Phosphonic Acid Derivatives and the Treating Agents of Diseases Related Hyperphosphatemia NR0B1, NR0B2, PTH1R SLC5A1 1236/4885SLC5A2 1771/4885THRA 582/4885

“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.