SCHEMBL20536736

SCHEMBL20536736

CC1(C)OB(c2c(F)cccc2C(F)(F)F)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.39
LIPG Q9Y5X9 7/20 0.39
HSD11B1 P28845 1/20 0.34
JAK2 O60674 2/20 0.33
BTK Q06187 2/20 0.33
F2 P00734 1/20 0.32
F11 P03951 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
SLC22A12 Q96S37 1/20 0.30
P2RX7 Q99572 1/20 0.30
CES1 P23141 1/20 0.30
AR P10275 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
SCHEMBL15026275 0.85 LPL (0.46) LPLLIPGJAK2BTKP2RX7
SCHEMBL29459939 0.81 LPL (0.40) LPLLIPGJAK2BTKF2
SCHEMBL20788915 0.81 LPL (0.40) LPLLIPGJAK2BTKF2
SCHEMBL24558106 0.79 AR (0.37) LPLLIPGAR
SCHEMBL29897342 0.79 LPL (0.41) LPLLIPGJAK2BTKP2RX7
SCHEMBL23301057 0.79 LPL (0.41) LPLLIPGJAK2BTKP2RX7
SCHEMBL29660618 0.77 LPL (0.36) LPLLIPG
SCHEMBL21458742 0.77 LIPG (0.40) LPLLIPGJAK2BTKF11
SCHEMBL31483909 0.77 LIPG (0.40) LPLLIPGJAK2BTKF11
SCHEMBL23301083 0.77 LPL (0.40) LPLLIPGJAK2BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3398945-B1 PYRIMIDINYL DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2022-11-02 EP disclosed
EP-3392247-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-29 EP disclosed
EP-3459943-B1 PYRIMIDINE-BASED ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-22 EP disclosed
EP-3459943-B1 PYRIMIDINE-BASED ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-22 EP disclosed
EP-3459943-A1 PYRIMIDINE-BASED ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-03-27 EP disclosed
EP-3459943-A1 PYRIMIDINE-BASED ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-03-27 EP disclosed
EP-3398945-A1 PYRIMIDINYL BENZENE DERIVATIVES AND THEIR USE IN OPTOELECTRONIC DEVICES cynora GmbH (DE) 2018-11-07 EP disclosed
EP-3392247-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-10-24 EP disclosed