SCHEMBL7523254

SCHEMBL7523254

O=C(O)COc1cccc2c1CC(SCc1ccccc1)c1sc(-c3ccccc3Cl)nc1-2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
POLB P06746 2/20 0.37
PTGIR P43119 5/20 0.36
FFAR1 O14842 1/20 0.36
PPARG P37231 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
FFAR2 O15552 1/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.35
PTGDR Q13258 2/20 0.34
PPARD Q03181 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL7524434 0.90 TP53 (0.41) KDM4EALDH1A1MAPTTP53POLB
SCHEMBL7523911 0.90 PTGIR (0.39) MAPTTP53POLBPTGIRFFAR1
SCHEMBL7526679 0.90 FFAR1 (0.38) KDM4EALDH1A1MAPTTP53POLB
SCHEMBL7526347 0.88 PTGIR (0.43) KDM4EALDH1A1MAPTTP53POLB
SCHEMBL7523182 0.88 PTGDR2 (0.41) PTGIRFFAR1PTGDR2PTGDRPPARD
SCHEMBL7518610 0.87 PTGIR (0.41) KDM4EALDH1A1PTGIRFFAR1PPARG
SCHEMBL7527946 0.85 PPARD (0.39) PTGIRFFAR1PTGDR2PTGDRPPARD
SCHEMBL7520993 0.85 PTGDR2 (0.43) PTGIRPTGDR2PTGDRPPARD
SCHEMBL7521474 0.85 PTGDR2 (0.39) POLBPTGIRFFAR1PPARGMEN1
SCHEMBL7522034 0.85 PTGIR (0.43) TP53POLBPTGIRFFAR1PPARG

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 RXFP1 119/4885KDM4E 4000/4885ALDH1A1 1662/4885

“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.