SCHEMBL28012175

SCHEMBL28012175

Cn1nc(-c2ccccc2Oc2ccccc2)c(-c2ccc(CO)cc2)cc1=O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 13/20 0.64
FFAR4 Q5NUL3 2/20 0.43
TTR P02766 1/20 0.42
PTGS2 P35354 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL15538629 0.91 BRD4 (0.61) BRD4FFAR4PTGS2
SCHEMBL28012062 0.91 BRD4 (0.64) BRD4FFAR4PTGS2
SCHEMBL15538363 0.89 BRD4 (0.59) BRD4FFAR4PTGS2
SCHEMBL28012051 0.89 BRD4 (0.65) BRD4FFAR4PTGS2
SCHEMBL20135835 0.88 BRD4 (0.58) BRD4FFAR4
SCHEMBL15559351 0.88 BRD4 (0.60) BRD4FFAR4PTGS2
SCHEMBL15539387 0.87 BRD4 (0.57) BRD4FFAR4PTGS2
SCHEMBL15539499 0.87 BRD4 (0.62) BRD4FFAR4PTGS2
SCHEMBL15538774 0.87 BRD4 (0.56) BRD4FFAR4PTGS2
SCHEMBL15541113 0.86 BRD4 (0.58) BRD4FFAR4PTGS2

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
CN-104884451-A Pyridinone and pyridazinone derivatives ABBVIE INC 2015-09-02 CN disclosed
CN-104718201-A Pyridinone and pyridazinone derivatives ABBVIE INC 2015-06-17 CN disclosed