SCHEMBL7528166

SCHEMBL7528166

CC(=O)Oc1coc2c(OCC(=O)O)cccc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.53
TBXA2R P21731 8/20 0.53
KDM4E B2RXH2 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL8318700 0.85 TSHR (0.52) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL28572048 0.81 LMNA (0.50) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL8318696 0.79 TSHR (0.47) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL7960057 0.78 PTGIR (0.58) PTGIRTBXA2RKDM4ETDP1ALDH1A1
SCHEMBL11637037 0.77 POLB (0.54) PTGIRTBXA2RKDM4ETDP1ALDH1A1
SCHEMBL20509857 0.77 KDM4E (0.54) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL12986383 0.76 L3MBTL1 (0.68) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL7960566 0.76 PTGIR (0.66) PTGIRTBXA2RKDM4ETDP1ALDH1A1
SCHEMBL31493900 0.76 TSHR (0.49) KDM4ETDP1ALDH1A1HPGDL3MBTL1
SCHEMBL28731922 0.76 TSHR (0.49) KDM4ETDP1ALDH1A1HPGDL3MBTL1

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-6417213-B2 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-07-09 US disclosed
US-20020006944-A1 Tricyclic compounds, their production and use OHKAWA SHIGENORI (JP) 2002-01-17 US disclosed
US-6248766-B1 CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-19 US 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-20020006944-A1 Tricyclic compounds, their production and use CNR1, PTGER1, PTGDR PTGIR 11/4885TBXA2R 5/4885KDM4E 4000/4885

“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.