SCHEMBL2865182

SCHEMBL2865182

CCOCCOc1ccc(Cc2ccc(C(=O)P(=O)(O)O)s2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.39
THRA P10827 1/20 0.39
SLC5A2 P31639 1/20 0.39
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
LTA4H P09960 3/20 0.36
HDAC6 Q9UBN7 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
PDE4A P27815 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
HDAC10 Q969S8 1/20 0.35
S1PR1 P21453 3/20 0.35
S1PR3 Q99500 3/20 0.35
S1PR4 O95977 1/20 0.35
S1PR5 Q9H228 1/20 0.35
ABL1 P00519 1/20 0.35

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
SCHEMBL2871048 0.89 SMN1; SMN2 (0.46) LTA4HHDAC6KDM4ECYP1A2CYP2D6
SCHEMBL2866272 0.89 POLB (0.46) POLBLMNASMN1; SMN2PLK1
SCHEMBL2867487 0.87 S1PR1 (0.47) HDAC6KDM4ECYP1A2CYP2D6PDE4A
SCHEMBL2867581 0.86 S1PR1 (0.49) HDAC6KDM4ECYP1A2CYP2D6PDE4A
SCHEMBL2871713 0.86 S1PR1 (0.49) HDAC6KDM4ECYP1A2CYP2D6PDE4A
SCHEMBL2859411 0.81 ALOX15 (0.41) THRASMN1; SMN2FFAR1
SCHEMBL2874081 0.80 PTPN1 (0.36) POLBKDM4ESMN1; SMN2ABL1
SCHEMBL2871257 0.79 NR4A2 (0.49) LMNAHDAC6CYP1A2SMN1; SMN2HIF1A
SCHEMBL2868563 0.78 POLB (0.44) ACACBPOLBLMNAKDM4ECYP1A2
SCHEMBL27703308 0.77 POLB (0.45) POLBLMNASMN1; SMN2PLK1

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 ACACB 3538/4885THRA 582/4885SLC5A2 1771/4885

“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.