SCHEMBL21608685

SCHEMBL21608685

CCCCC(CC)CCc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(CCC(CC)CCCC)cc6F)s5)c5nsnc45)c4nsnc34)s2)c(F)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL16265269 0.99 ESR1 (0.32) ESR1ESR2SMN1; SMN2
SCHEMBL29331973 0.96 RARB (0.34) ESR1ESR2
SCHEMBL20806203 0.95 — —
SCHEMBL17694366 0.95 ESR1 (0.33) ESR1ESR2
SCHEMBL21596530 0.93 ESR1 (0.31) ESR1ESR2
SCHEMBL21608613 0.93 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL17176822 0.91 — —
SCHEMBL21914655 0.91 RARB (0.31) —
SCHEMBL21241716 0.90 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL29332167 0.90 SMN1; SMN2 (0.32) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043782-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 — — US disclosed
US-12043782-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 — — US disclosed
WO-2019243216-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-12-26 — — WO disclosed
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