SCHEMBL8727274

SCHEMBL8727274

C=CC1CCC(C2CCC(c3ccc(-c4ccc(COC)cc4)cc3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
ERN1 O75460 1/20 0.33
PTGS2 P35354 1/20 0.32
ESR2 Q92731 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 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
SCHEMBL8727281 1.00 L3MBTL1 (0.33) L3MBTL1ERN1PTGS2ESR2SPHK1
SCHEMBL8727265 1.00 L3MBTL1 (0.33) L3MBTL1ERN1PTGS2ESR2SPHK1
SCHEMBL8732494 0.96 ERN1 (0.35) L3MBTL1ERN1PTGS2ESR2SPHK1
SCHEMBL8731088 0.96 ERN1 (0.35) L3MBTL1ERN1PTGS2ESR2SPHK1
SCHEMBL8732489 0.96 ERN1 (0.35) L3MBTL1ERN1PTGS2ESR2SPHK1
SCHEMBL8727228 0.96 ESR2 (0.33) L3MBTL1ESR2SPHK1CARM1PRMT6
SCHEMBL8727222 0.96 ESR2 (0.33) L3MBTL1ESR2SPHK1CARM1PRMT6
SCHEMBL8727231 0.96 ESR2 (0.33) L3MBTL1ESR2SPHK1CARM1PRMT6
SCHEMBL8732542 0.92 ESR2 (0.36) L3MBTL1ESR2SPHK1CARM1PRMT6
SCHEMBL8732537 0.92 ESR2 (0.36) L3MBTL1ESR2SPHK1CARM1PRMT6

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-0882695-A1 BENZYL ETHER DERIVATIVES, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1998-12-09 EP disclosed