SCHEMBL562235

SCHEMBL562235

CNC(=O)COc1cc(C)c(-c2cccc(CNc3ccc4c(c3)CC3(CC3)C4C(C)C(=O)O)c2C)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 13/20 0.34
FFAR1 O14842 6/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
PDCD1 Q15116 4/20 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
SCHEMBL10264281 0.87 FFAR1 (0.39) CD274FFAR1MAPTMAPK1PDCD1
SCHEMBL563199 0.85 MAPK14 (0.38) CD274FFAR1PDCD1
SCHEMBL10268442 0.85 CD274 (0.36) CD274FFAR1MAPTMAPK1PDCD1
SCHEMBL562586 0.84 FFAR1 (0.33) CD274FFAR1PDCD1
SCHEMBL562884 0.79 FFAR1 (0.41) CD274FFAR1PDCD1
SCHEMBL10264469 0.77 FFAR1 (0.40) CD274FFAR1PDCD1
SCHEMBL562073 0.77 MAPK14 (0.34) CD274PDCD1
SCHEMBL562587 0.76 PDCD1 (0.30) CD274PDCD1
SCHEMBL562661 0.76 FFAR1 (0.42) CD274FFAR1PDCD1
SCHEMBL562579 0.76 FFAR1 (0.42) CD274FFAR1PDCD1

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 2 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 disclosed
US-20120035196-A1 CARBOXYLIC ACID COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-09 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-20120035196-A1 CARBOXYLIC ACID COMPOUND GPR119, GPR65, GPR55 CD274 3683/4885FFAR1 23/4885MAPT 4290/4885

“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.