SCHEMBL2859683

SCHEMBL2859683

O=C(c1ccc(O)c(Cc2ccc(O)cc2)c1)P(=O)(O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.45
CYP3A4 P08684 3/20 0.40
HIF1A Q16665 3/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX12 P18054 1/20 0.40
CYP2C19 P33261 1/20 0.40
CKS1B P61024 1/20 0.40
SKP2 Q13309 1/20 0.40
SLC7A5 Q01650 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
PTPN1 P18031 1/20 0.39
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38

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
SCHEMBL2873161 0.88 HSP90AA1 (0.47) CYP3A4HIF1AHPGDALOX15HSD17B10
SCHEMBL27703314 0.86 SLC7A5 (0.36) KEAP1CYP3A4HIF1AHPGDALOX15
SCHEMBL2867645 0.85 PLK1 (0.42) ALOX15ALDH1A1HSP90AA1MAPT
SCHEMBL2871299 0.85 PLK1 (0.42) SLC7A5HSP90AA1HSP90AB1PKM
SCHEMBL2865180 0.84 EPHX2 (0.40) HSP90AA1HSP90AB1PKM
SCHEMBL2872116 0.83 SRD5A2 (0.52) CYP3A4HIF1AHPGDALOX15HSD17B10
SCHEMBL2866387 0.83 HSP90AA1 (0.39) CYP3A4HIF1AHPGDALOX15HSD17B10
SCHEMBL2871067 0.83 HSP90AA1 (0.39) ALDH1A1HSP90AA1HSP90AB1PKMMAPT
SCHEMBL2872134 0.83 MAPT (0.47) HPGDALOX15HSD17B10ALDH1A1TP53
SCHEMBL2869093 0.82 POLB (0.43) HPGDTP53SLC7A5MAPTKMT2A

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 4 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
EP-1813620-A1 PHOSPHONIC ACID DERIVATIVE AND THERAPEUTIC AGENT FOR DISEASE IN WHICH HIGH PHOSPHATE LEVEL IN BLOOD PARTICIPATES Kotobuki Pharmaceutical Co., Ltd. (JP) 2007-08-01 EP 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 KEAP1 3388/4885CYP3A4 2851/4885HIF1A 1218/4885

“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.