SCHEMBL2861283

SCHEMBL2861283

CCc1ccc(Cc2cc(CCl)ccc2OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 6/20 0.47
SLC5A2 P31639 6/20 0.47
TTR P02766 2/20 0.46
AKT1 P31749 1/20 0.43
CA2 P00918 1/20 0.43
CYP3A4 P08684 2/20 0.41
TUBB1 Q9H4B7 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
PTGS2 P35354 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL2864646 0.87 CA2 (0.52) SLC5A1SLC5A2TTRAKT1CA2
SCHEMBL2872105 0.83 SLC5A1 (0.47) SLC5A1SLC5A2AKT1CA2CYP3A4
SCHEMBL2868462 0.83 CSNK2A1 (0.44) SLC5A1SLC5A2AKT1MEN1KMT2A
SCHEMBL2872097 0.83 CSNK2A1 (0.42) SLC5A1SLC5A2TTRAKT1MEN1
SCHEMBL5598123 0.82 TTR (0.54) TTRCA2MEN1KMT2AGAA
SCHEMBL30776597 0.82 TTR (0.54) TTRCA2MEN1KMT2AGAA
SCHEMBL2576249 0.80 KDM4E (0.48) SLC5A1SLC5A2CA2CYP3A4MEN1
SCHEMBL2865170 0.79 PTGER1 (0.44) MEN1KMT2AGAA
SCHEMBL2873156 0.77 SLC5A2 (0.48) SLC5A1SLC5A2GAA
SCHEMBL9705593 0.77 TTR (0.50) TTR

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 SLC5A1 1236/4885SLC5A2 1771/4885TTR 1549/4885

“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.