SCHEMBL7519310

SCHEMBL7519310

O=C(O)COc1cccc2c1CCc1sc(SC(c3ccccc3)c3ccccc3)nc1-2

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 17/20 0.43
TBXA2R P21731 4/20 0.38
PTGDR Q13258 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL7523179 0.95 PTGIR (0.40) PTGIRTBXA2RPTGDR
SCHEMBL7518608 0.95 PTGIR (0.40) PTGIRTBXA2RPTGDRTDP1NPC1
SCHEMBL7524431 0.94 PTGIR (0.40) PTGIRTBXA2RPTGDR
SCHEMBL7528277 0.93 PTGDR2 (0.41) PTGIRPTGDRKDM4EALDH1A1HPGD
SCHEMBL7526342 0.93 PTGIR (0.41) PTGIRTBXA2RPTGDR
SCHEMBL7555836 0.93 PTGIR (0.41) PTGIRTBXA2RPTGDR
SCHEMBL7522033 0.93 PTGIR (0.41) PTGIRTBXA2RPTGDRKDM4EALDH1A1
SCHEMBL7520989 0.93 PPARD (0.40) PTGIRPTGDRNPC1RAB9A
SCHEMBL7522740 0.92 PTGIR (0.37) PTGIRPTGDRKDM4EALDH1A1HPGD
SCHEMBL7521471 0.92 PTGIR (0.38) PTGIRTBXA2RPTGDR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020006944-A1 Tricyclic compounds, their production and use OHKAWA SHIGENORI (JP) 2002-01-17 US claimed
US-6248766-B1 CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-19 US claimed
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 5/4885PTGDR 3/4885

“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.