SCHEMBL21728136

SCHEMBL21728136

C1=CC(c2cc(-c3ccccc3)nc(-c3ccc(C4(c5ccc(-c6cccc(-c7cccc8c7C=CCC8)c6)cc5)CCCCC4)cc3)n2)=CCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.32
HSD11B1 P28845 1/20 0.30

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
SCHEMBL21728469 0.95 PGR (0.33) PGRHSD11B1
SCHEMBL21728110 0.92 HSD11B1 (0.32) PGRHSD11B1
SCHEMBL21728497 0.92 HSD11B1 (0.32) PGRHSD11B1
SCHEMBL21728297 0.89 PGR (0.39) PGRHSD11B1
SCHEMBL21728115 0.87
SCHEMBL21728293 0.86
SCHEMBL21728448 0.86 MEN1 (0.39) PGRHSD11B1
SCHEMBL21728348 0.84 MEN1 (0.31)
SCHEMBL21728305 0.84 MEN1 (0.31)
SCHEMBL21728295 0.84 MEN1 (0.37) PGRHSD11B1

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-3214084-B1 CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEMICAL LTD (KR) 2020-02-19 EP disclosed