SCHEMBL7526679

SCHEMBL7526679

Cc1ccccc1-c1nc2c(s1)C(SCc1ccccc1)Cc1c(OCC(=O)O)cccc1-2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.38
PTGIR P43119 6/20 0.36
LMNA P02545 2/20 0.35
PPARD Q03181 4/20 0.35
PPARG P37231 1/20 0.35
KDM4E B2RXH2 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
PTGDR Q13258 3/20 0.34
POLB P06746 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL7518610 0.90 PTGIR (0.41) FFAR1PTGIRLMNAPPARDPPARG
SCHEMBL7523911 0.90 PTGIR (0.39) FFAR1PTGIRPPARDPTGDRPOLB
SCHEMBL7523254 0.90 RXFP1 (0.40) FFAR1PTGIRPPARDPPARGKDM4E
SCHEMBL7522034 0.88 PTGIR (0.43) FFAR1PTGIRPPARDPPARGPTGDR2
SCHEMBL7523182 0.88 PTGDR2 (0.41) FFAR1PTGIRPPARDPTGDR2PTGDR
SCHEMBL7520993 0.87 PTGDR2 (0.43) PTGIRPPARDPTGDR2PTGDR
SCHEMBL7524434 0.87 TP53 (0.41) PTGIRPPARDKDM4EPTGDR2PTGDR
SCHEMBL7527946 0.85 PPARD (0.39) FFAR1PTGIRPPARDPTGDR2PTGDR
SCHEMBL7521474 0.85 PTGDR2 (0.39) FFAR1PTGIRPPARDPPARGPTGDR2
SCHEMBL7555841 0.85 PTGIR (0.43) FFAR1PTGIRPPARDKDM4EPTGDR2

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 FFAR1 53/4885PTGIR 11/4885LMNA 2418/4885

“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.