SCHEMBL562641

SCHEMBL562641

COCCCOc1cc(C)c(-c2cccc(COc3ccc4c(c3)OC3(CC3)C4CC(=O)O)c2C)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.41
GNA15 P30679 1/20 0.41
SLC10A1 Q14973 1/20 0.41
ABCC2 Q92887 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
PPARG P37231 4/20 0.40
PPARD Q03181 4/20 0.40
CD274 Q9NZQ7 1/20 0.39

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
SCHEMBL562175 0.96 FFAR1 (0.42) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL562539 0.96 FFAR1 (0.42) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL563210 0.96 FFAR1 (0.42) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL10203936 0.94 FFAR1 (0.44) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL10203955 0.93 FFAR1 (0.42) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL10203935 0.92 FFAR1 (0.41) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL562098 0.92 CD274 (0.43) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL563361 0.92 CD274 (0.43) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL563287 0.92 CD274 (0.43) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL10203934 0.90 FFAR1 (0.53) FFAR1GNA15SLC10A1ABCC2SLCO1B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423176-A1 CARBOXYLIC ACID COMPOUND Astellas Pharma Inc. (JP) 2012-02-29 EP claimed
US-20120035196-A1 CARBOXYLIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-09 US claimed
EP-2423176-A1 CARBOXYLIC ACID COMPOUND Astellas Pharma Inc. (JP) 2012-02-29 EP disclosed
US-20120035196-A1 CARBOXYLIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-09 US disclosed
US-20120035196-A1 CARBOXYLIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-09 US disclosed
US-20120035196-A1 CARBOXYLIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-09 US disclosed
WO-2010123016-A1 CARBOXYLIC ACID COMPOUND アステラス製薬株式会社 (JP) 2010-10-28 WO 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-20120035196-A1 CARBOXYLIC ACID COMPOUND GPR119, GPR65, GPR55 FFAR1 23/4885GNA15 1220/4885SLC10A1 138/4885

“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.