SCHEMBL9546468

SCHEMBL9546468

FC(F)(F)c1cccc(Oc2ccccc2Br)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.49
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
EPAS1 Q99814 1/20 0.46
TEAD1 P28347 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
MAPT P10636 2/20 0.46
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
ATM Q13315 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44
ADORA2A P29274 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
RXFP1 Q9HBX9 1/20 0.41
GAA P10253 1/20 0.41
LTA4H P09960 1/20 0.41

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
SCHEMBL1417678 0.83 THRA (0.52) L3MBTL1THRATHRBEPAS1TEAD1
SCHEMBL3839158 0.82 ALDH1A1 (0.44) L3MBTL1MAPTALDH1A1POLBGAA
SCHEMBL31343828 0.81 SLC6A4 (0.47) L3MBTL1THRBMAPTATMALDH1A1
SCHEMBL21858140 0.81 SLC6A4 (0.47) L3MBTL1THRBMAPTATMALDH1A1
SCHEMBL1341034 0.80 L3MBTL1 (0.60) L3MBTL1NPSR1MAPTCYP1A2CYP2C9
SCHEMBL4697065 0.80 AR (0.54) L3MBTL1TEAD1NPSR1MAPTCYP1A2
SCHEMBL19563690 0.80 L3MBTL1 (0.56) L3MBTL1NPSR1MAPTCYP1A2CYP2C9
SCHEMBL8941708 0.80 AR (0.54) L3MBTL1THRATHRBEPAS1NPSR1
SCHEMBL2094927 0.80 L3MBTL1 (0.49) L3MBTL1EPAS1TEAD1NPSR1MAPT
SCHEMBL9798371 0.80 LTA4H (0.54) L3MBTL1TEAD1NPSR1MAPTCYP1A2

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
WO-1993024600-A1 OXIDATION-RESISTANT CYCLOPHOSPHAZENE FLUID INCLUDING TRIARYLPHOSPHINE OR PHOSPHINE OXIDE THE DOW CHEMICAL COMPANY (US) 1993-12-09 WO disclosed
US-5194652-A High temperature lubricants, hydraulic fluids; jet aircraft, turbines, diesel engines THE DOW CHEMICAL COMPANY (US) 1993-03-16 US disclosed