SCHEMBL2869093

SCHEMBL2869093

CC(C)Oc1ccc(Cc2cc(C(=O)P(=O)(O)O)ccc2O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
KMT2A Q03164 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
PARP10 Q53GL7 1/20 0.41
KDM4A O75164 1/20 0.40
MAPT P10636 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
SLC5A1 P13866 1/20 0.39
SLC5A2 P31639 1/20 0.39
F10 P00742 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
HPGD P15428 2/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
TSPO P30536 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL2867645 0.86 PLK1 (0.42) POLBMAPTSLC5A1SLC5A2NPC1
SCHEMBL2872134 0.84 MAPT (0.47) NR1H4PARP10MAPTSLC5A1SLC5A2
SCHEMBL2873352 0.82 POLB (0.38) POLBKMT2ANR1H4PARP10TP53
SCHEMBL2867926 0.82 PLK1 (0.49) MAPTSLC5A1SLC5A2NPC1RAB9A
SCHEMBL2859727 0.82 GSTA1 (0.45) KMT2ATP53NPC1RAB9ASMN1; SMN2
SCHEMBL2873161 0.82 HSP90AA1 (0.47) POLBTP53MAPK1HPGDCNR1
SCHEMBL2859683 0.82 KEAP1 (0.45) KMT2AMAPTTP53HPGDSLC7A5
SCHEMBL2872116 0.81 SRD5A2 (0.52) KMT2APARP10HPGDSLC7A5
SCHEMBL2871495 0.81 GAA (0.42) SLC5A1SLC5A2SLC7A5
SCHEMBL2870283 0.79 TP53 (0.49) TP53

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
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 POLB 2456/4885KMT2A 3915/4885NR1H4 19/4885

“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.