SCHEMBL21098569

SCHEMBL21098569

C=C(C)C(=O)OCCCc1cc(-c2ccc(-c3ccc(C4CCC(C)CC4)cc3)c(CC)c2)cc(CCCOC(=O)C(=C)C)c1OCCC(C)(CO)CO

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32

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
SCHEMBL21033684 0.98 FFAR4 (0.33) FFAR4CNR1CNR2
SCHEMBL21033683 0.95 CNR1 (0.33) FFAR4CNR1CNR2
SCHEMBL21115449 0.94 CNR1 (0.34) FFAR4CNR1CNR2
SCHEMBL21098608 0.94 CNR1 (0.34) FFAR4CNR1CNR2
SCHEMBL21098019 0.92
SCHEMBL21098589 0.92 CNR1 (0.32) FFAR4CNR1CNR2
SCHEMBL21097818 0.91 CNR1 (0.33) CNR1CNR2
SCHEMBL21115971 0.91 FFAR4 (0.32) FFAR4
SCHEMBL24180749 0.91 FFAR4 (0.34) FFAR4
SCHEMBL21097856 0.91 FFAR4 (0.33) FFAR4CNR1CNR2

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
US-11072742-B2 Liquid-crystalline media having homeotropic alignment MERCK PATENT GMBH (DE) 2021-07-27 US disclosed
US-20190185754-A1 LIQUID-CRYSTALLINE MEDIA HAVING HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2019-06-20 US disclosed