SCHEMBL9901751

SCHEMBL9901751

CCCCCCCCCCc1ccc(Nc2ccccc2B2OC(C)(C)C(C)(C)O2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 6/20 0.58
▸ LIPG Q9Y5X9 6/20 0.58
▸ THRA P10827 2/20 0.40
▸ THRB P10828 2/20 0.40
▸ PLK1 P53350 4/20 0.39
▸ UNG P13051 3/20 0.39
▸ HTR2A P28223 2/20 0.39
▸ PLK3 Q9H4B4 3/20 0.38
▸ MAPT P10636 1/20 0.37
▸ ESR1 P03372 2/20 0.37
▸ ADRA2A P08913 2/20 0.37
▸ ADORA3 P0DMS8 2/20 0.37
▸ TACR2 P21452 2/20 0.37
▸ SLC6A2 P23975 2/20 0.37
▸ SLC6A4 P31645 2/20 0.37
▸ SLC6A3 Q01959 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ SHBG P04278 1/20 0.37

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
SCHEMBL9900998 1.00 LPL (0.58) LPLLIPGTHRATHRBPLK1
SCHEMBL20829056 0.78 LPL (0.43) LPLLIPGMAPTSLC6A2KDM4E
SCHEMBL9901870 0.77 LPL (0.44) LPLLIPGLMNACYP3A4CHRM2
SCHEMBL20829077 0.76 LIPG (0.54) LPLLIPGMAPTKDM4E
SCHEMBL19001570 0.74 LPL (1.00) LPLLIPGHTR2AESR1ADRA2A
SCHEMBL18727878 0.74 LPL (1.00) LPLLIPGHTR2AESR1ADRA2A
SCHEMBL14227371 0.74 LPL (1.00) LPLLIPGHTR2AESR1ADRA2A
SCHEMBL1353091 0.74 LPL (1.00) LPLLIPGHTR2AESR1ADRA2A
SCHEMBL1513184 0.74 LPL (1.00) LPLLIPGHTR2AESR1ADRA2A
SCHEMBL18462914 0.74 LPL (0.67) LPLLIPGHTR2AMAPTESR1

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-2649073-A2 PROCESS FOR THE PREPARATION OF SEMICONDUCTOR MATERIALS, COMPOUNDS AND THEIR USE The University Of Manchester (GB) 2013-10-16 — — EP disclosed
WO-2012076886-A2 NOVEL PROCESS AND COMPOUNDS THE UNIVERSITY OF MANCHESTER (GB) 2012-06-14 — — WO disclosed
WO-2012076886-A2 NOVEL PROCESS AND COMPOUNDS THE UNIVERSITY OF MANCHESTER (GB) 2012-06-14 — — WO disclosed
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