SCHEMBL5051990

SCHEMBL5051990

[Li]c1ccc(Br)s1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7085069 0.75
SCHEMBL1522530 0.69
SCHEMBL197157 0.67 SNCA (0.50)
SCHEMBL5889194 0.65 SNCA (0.48)
SCHEMBL5889177 0.65 SNCA (0.48)
SCHEMBL8384237 0.62
SCHEMBL131605 0.62
SCHEMBL15880159 0.62
SCHEMBL2184625 0.62
SCHEMBL153465 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023285788-A1 SULFUR COMPOUNDS AND PROCESSES AND INTERMEDIATES USEFUL IN THE PREPARATION THEREOF OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2023-01-19 WO disclosed
EP-1877462-A1 SEMICONDUCTORS CONTAINING PERFLUOROETHER ACYL OLIGOTHIOPHENE COMPOUNDS 3M Innovative Properties Company (US) 2008-01-16 EP disclosed
US-7211679-B2 Perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-01 US disclosed
US-7151276-B2 Semiconductors containing perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-12-19 US disclosed
WO-2006098859-A1 SEMICONDUCTORS CONTAINING PERFLUOROETHER ACYL OLIGOTHIOPHENE COMPOUNDS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-09-21 WO disclosed
US-20060202191-A1 Semiconductors containing perfluoroether acyl oligothiohpene compounds 3M INNOVATIVE PROPERTIES COMPANY 2006-09-14 US disclosed
US-20060205172-A1 Perfluoroether acyl oligothiophene compounds 3M INNOVATIVE PROPERTIES COMPANY 2006-09-14 US disclosed
US-6172205-B1 DEHALOGENATION, ACID CATALYSIS, CYCLIZATION, RING CONTRACTION; ANTICARCINOGENIC AGENTS THE TRUSTEES OF COLUMBIA IN THE CITY OF NEW YORK 2001-01-09 US disclosed
WO-1999029704-A1 A SYNTHETIC PROCESS TOWARD TOTAL SYNTHESIS OF ELEUTHERUBIN AND ITS ANALOGUES AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1999-06-17 WO disclosed