SCHEMBL27837553

SCHEMBL27837553

CC(NC(=O)c1cccc2ccn(Cc3ccc(-c4ccccc4)nc3)c12)c1ccc(C(=O)O)cc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 16/20 0.68
PTGDR Q13258 10/20 0.68
PPARG P37231 2/20 0.49
PHGDH O43175 2/20 0.46

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
SCHEMBL988187 1.00 PTGER4 (0.68) PTGER4PTGDRPPARGPHGDH
SCHEMBL12585526 0.89 PTGER4 (0.69) PTGER4PTGDRPPARG
SCHEMBL988305 0.89 PTGER4 (0.78) PTGER4PTGDRPPARG
SCHEMBL27855423 0.89 PTGER4 (0.78) PTGER4PTGDRPPARG
SCHEMBL986598 0.88 PTGER4 (0.73) PTGER4PTGDRPPARG
SCHEMBL28792397 0.88 PTGER4 (0.73) PTGER4PTGDRPPARG
SCHEMBL12900354 0.86 PTGER4 (0.85) PTGER4PTGDRPPARG
SCHEMBL12900400 0.86 PTGER4 (0.77) PTGER4PTGDRPPARG
SCHEMBL27837551 0.86 PTGER4 (0.67) PTGER4PTGDRPPARG
SCHEMBL987945 0.86 PTGER4 (0.67) PTGER4PTGDRPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102026961-A Amide compound ASTELLAS PHARMA INC 2011-04-20 CN disclosed