SCHEMBL9494460

SCHEMBL9494460

Clc1cccc(Oc2ccc3cc(Oc4cccc(Cl)n4)ccc3c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
F2 P00734 3/20 0.42
F10 P00742 3/20 0.42
HAO1 Q9UJM8 1/20 0.42
PPARG P37231 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41
MAP4K4 O95819 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
BACE1 P56817 1/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL9493641 0.96 L3MBTL1 (0.54) L3MBTL1F2F10HAO1PPARG
SCHEMBL9490952 0.90 L3MBTL1 (0.62) L3MBTL1F2F10PPARGPRSS1
SCHEMBL9491757 0.90 L3MBTL1 (0.53) L3MBTL1F2F10HAO1PPARG
SCHEMBL9492874 0.88 L3MBTL1 (0.51) L3MBTL1F2F10PPARGPRSS1
SCHEMBL959384 0.85 L3MBTL1 (0.57) L3MBTL1F2F10PPARGMAP4K4
SCHEMBL9496948 0.84 L3MBTL1 (0.49) L3MBTL1F2F10HAO1PPARG
SCHEMBL958339 0.84 MEN1 (0.51) L3MBTL1F2F10HAO1PRSS1
SCHEMBL9491919 0.84 L3MBTL1 (0.47) L3MBTL1F2F10HAO1PPARG
SCHEMBL9493267 0.84 L3MBTL1 (0.47) L3MBTL1F2F10HAO1PPARG
SCHEMBL962086 0.82 L3MBTL1 (0.46) L3MBTL1PTGS2

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
EP-0255778-B1 THERMOPLASTIC AROMATIC POLYETHER-PYRIDINES AND PROCESS FOR PREPARING SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-03-03 EP disclosed
US-4803258-A FROM DIHALOGENOPYRIDINE AND DIOL, MOLDING MATERIALS, FILMS, WIRE COATING MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1989-02-07 US disclosed
EP-0255778-A1 Thermoplastic aromatic polyether-pyridines and process for preparing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1988-02-10 EP disclosed