SCHEMBL28029416

SCHEMBL28029416

CCOc1ccc(-c2cc(=O)n(C)nc2-c2ccccc2Oc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 11/20 0.63
FFAR4 Q5NUL3 1/20 0.45
BCL2 P10415 1/20 0.43
MDM2 Q00987 1/20 0.43
MCL1 Q07820 1/20 0.43
LTA4H P09960 1/20 0.43
HTR3A P46098 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
SCHEMBL28012062 0.85 BRD4 (0.64) BRD4FFAR4
SCHEMBL28012175 0.85 BRD4 (0.64) BRD4FFAR4LTA4H
SCHEMBL15552984 0.85 BRD4 (0.67) BRD4
SCHEMBL28012051 0.83 BRD4 (0.65) BRD4FFAR4
SCHEMBL15538629 0.83 BRD4 (0.61) BRD4FFAR4MDM2
SCHEMBL28029723 0.83 BRD4 (0.64) BRD4
SCHEMBL15538361 0.83 BRD4 (0.58) BRD4FFAR4
SCHEMBL28029426 0.83 BRD4 (0.58) BRD4FFAR4
SCHEMBL15552670 0.83 BRD4 (0.67) BRD4
SCHEMBL15559351 0.83 BRD4 (0.60) BRD4FFAR4

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