SCHEMBL20969352

SCHEMBL20969352

CC1(C)OB(c2cccc(C3(c4cccc(Cl)c4)c4ccccc4-c4ccccc43)c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.39
LPL P06858 4/20 0.39
LIPG Q9Y5X9 4/20 0.39
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
PGR P06401 2/20 0.34
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDK2 Q15119 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
CHRNA1 P02708 3/20 0.32
CHRNB1 P11230 3/20 0.32
CHRNB2 P17787 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
SCHEMBL12166505 0.92 LIPG (0.43) EGFRLPLLIPGESR1ESR2
SCHEMBL17470489 0.89 LIPG (0.44) LPLLIPGESR1ESR2LMNA
SCHEMBL29603064 0.89 LIPG (0.44) LPLLIPGESR1ESR2LMNA
SCHEMBL17816784 0.88 LIPG (0.43) LPLLIPGESR1ESR2LMNA
SCHEMBL24336518 0.85 ESR1 (0.39) LPLLIPGESR1ESR2LMNA
SCHEMBL19735690 0.85 LIPG (0.40) LPLLIPGESR1ESR2LMNA
SCHEMBL22173458 0.85 LIPG (0.50) LPLLIPGESR1ESR2LMNA
SCHEMBL22173457 0.84 LIPG (0.52) LPLLIPGESR1ESR2LMNA
SCHEMBL105120 0.81 LPL (0.38) LPLLIPGESR1ESR2LMNA
SCHEMBL3957889 0.80 ESR1 (0.47) ESR1ESR2PGRLMNAKDM4E

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
EP-3483154-A1 COMPOUNDS COMPRISING TRIAZINE, FLUORENE AND ARYL GROUPS AND THEIR USE IN ORGANIC ELECTRONIC DEVICES Novaled GmbH (DE) 2019-05-15 EP disclosed
EP-3483154-A1 COMPOUNDS COMPRISING TRIAZINE, FLUORENE AND ARYL GROUPS AND THEIR USE IN ORGANIC ELECTRONIC DEVICES Novaled GmbH (DE) 2019-05-15 EP disclosed