SCHEMBL2872134

SCHEMBL2872134

CCOc1ccc(Cc2cc(C(=O)P(=O)(O)O)ccc2O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALOX15 P16050 2/20 0.47
RECQL P46063 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PLK1 P53350 1/20 0.47
SLC5A1 P13866 2/20 0.47
SLC5A2 P31639 2/20 0.47
NPC1 O15118 5/20 0.43
RAB9A P51151 4/20 0.43
LMNA P02545 2/20 0.43
PARP10 Q53GL7 1/20 0.42
EPHX2 P34913 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 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
SCHEMBL2859727 0.90 GSTA1 (0.45) KDM4EPLK1NPC1RAB9ALMNA
SCHEMBL2867926 0.90 PLK1 (0.49) MAPTALDH1A1KDM4EHSD17B10PLK1
SCHEMBL2861309 0.90 THRA (0.43) MAPTALDH1A1HPGDKDM4EALOX15
SCHEMBL2869970 0.89 ALDH1A1 (0.47) MAPTALDH1A1HPGDKDM4EALOX15
SCHEMBL2871239 0.87 TP53 (0.49) TP53
SCHEMBL2870283 0.87 TP53 (0.49) TP53
SCHEMBL2867645 0.87 PLK1 (0.42) MAPTALDH1A1ALOX15PLK1SLC5A1
SCHEMBL2868147 0.87 ALDH1A1 (0.46) MAPTALDH1A1HPGDKDM4EALOX15
SCHEMBL2871495 0.86 GAA (0.42) ALDH1A1RECQLPLK1SLC5A1SLC5A2
SCHEMBL2873161 0.85 HSP90AA1 (0.47) ALDH1A1HPGDALOX15HSD17B10PLK1

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 MAPT 4759/4885ALDH1A1 3773/4885HPGD 1495/4885

“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.