SCHEMBL24314698

SCHEMBL24314698

C1=Cc2cc(-c3nc(-c4ccc(-c5cccc6oc7ccc(-c8cccc9ccccc89)cc7c56)c5ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)ccc2CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL25853422 0.92 MET (0.31) CA12CA9
SCHEMBL24315155 0.92
SCHEMBL24315442 0.90 TSHR (0.31)
SCHEMBL24585677 0.89 PIM1 (0.30)
SCHEMBL24315131 0.88 BACE1 (0.33)
SCHEMBL25653095 0.88 BACE1 (0.35) CA12CA9
SCHEMBL26896536 0.87 BACE1 (0.30)
SCHEMBL24315143 0.87 KDM4E (0.33) CA12CA9
SCHEMBL24315272 0.87 AHR (0.33)
SCHEMBL24357017 0.87 TSHR (0.32)

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
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed