SCHEMBL1829065

SCHEMBL1829065

CCCCCCc1cc(B2OC(C)(C)C(C)(C)O2)sc1Br

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 6/20 0.47
▸ LIPG Q9Y5X9 6/20 0.47
▸ TDP1 Q9NUW8 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ TYR P14679 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ACE2 Q9BYF1 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ GPR35 Q9HC97 1/20 0.31

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
SCHEMBL16487744 0.83 LPL (0.47) LPLLIPGTDP1MEN1TP53
SCHEMBL6157227 0.82 LPL (0.46) LPLLIPGTDP1MEN1TP53
SCHEMBL12338988 0.82 LPL (0.46) LPLLIPGTDP1MEN1TP53
SCHEMBL19809500 0.80 LPL (0.47) LPLLIPGTDP1MEN1TP53
SCHEMBL15978009 0.77 LPL (0.41) LPLLIPG
SCHEMBL12715489 0.75 LPL (0.45) LPLLIPGGPR35
SCHEMBL11924899 0.75 LPL (0.47) LPLLIPGGPR35
SCHEMBL16919575 0.75 LPL (0.47) LPLLIPGGPR35
SCHEMBL9885169 0.74 LPL (0.39) LPLLIPG
SCHEMBL12338999 0.74 LPL (0.41) LPLLIPGTDP1MEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501902-B2 Process for the polymerisation of thiophene or selenophene compounds MERCK PATENT GMBH (DE) 2013-08-06 — — US disclosed
US-8501902-B2 Process for the polymerisation of thiophene or selenophene compounds MERCK PATENT GMBH (DE) 2013-08-06 — — US disclosed
EP-1754736-B1 Process for the polymerisation of thiophene or selenophene derivatives MERCK PATENT GMBH (DE) 2011-05-11 — — EP disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — US disclosed
US-20070045592-A1 Process for the polymerisation of thiophene or selenophene compounds FLEXENABLE TECHNOLOGY LIMITED (GB) 2007-03-01 — — US disclosed
US-20070045592-A1 Process for the polymerisation of thiophene or selenophene compounds FLEXENABLE TECHNOLOGY LIMITED (GB) 2007-03-01 — — US disclosed
EP-1754736-A1 Process for the polymerisation of thiophene or selenophene derivatives Merck Patent GmbH (DE) 2007-02-21 — — EP disclosed
Send feedback