SCHEMBL14700445

SCHEMBL14700445

Brc1cc2c(s1)-c1sc(Br)cc1C1(OCCO1)C21OCCO1

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
SCHEMBL15929898 1.00 — —
SCHEMBL15929903 0.87 — —
SCHEMBL25470993 0.75 — —
SCHEMBL14882811 0.75 — —
SCHEMBL15422364 0.72 — —
SCHEMBL10046696 0.72 — —
SCHEMBL15929924 0.69 KDM4E (0.38) —
SCHEMBL15625394 0.69 — —
SCHEMBL15929905 0.66 RPS6KB2 (0.39) —
SCHEMBL27142401 0.65 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023091151-A1 FUSED DITHIENO BENZOTHIADIAZOLE POLYMERS FOR ORGANIC PHOTOVOLTAICS PHILLIPS 66 COMPANY (US) 2023-05-25 — — WO disclosed
WO-2023091152-A1 FUSED DITHIENO BENZOTHIADIAZOLE POLYMERS FOR ORGANIC PHOTOVOLTAICS PHILLIPS 66 COMPANY (US) 2023-05-25 — — WO disclosed
WO-2023091153-A1 FUSED DITHIENO BENZOTHIADIAZOLE POLYMERS FOR ORGANIC PHOTOVOLTAICS PHILLIPS 66 COMPANY (US) 2023-05-25 — — WO disclosed
WO-2023091154-A1 FUSED DITHIENO BENZOTHIADIAZOLE POLYMERS FOR ORGANIC PHOTOVOLTAICS PHILLIPS 66 COMPANY (US) 2023-05-25 — — WO disclosed
US-20140221664-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (ELECTRON WITHDRAWING GROUPS) GEORGIA TECH RESEARCH CORPORATION (US) 2014-08-07 — — US disclosed
US-20140221664-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (ELECTRON WITHDRAWING GROUPS) GEORGIA TECH RESEARCH CORPORATION (US) 2014-08-07 — — US disclosed
US-20130102785-A1 METHOD OF MAKING COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING GEORGIA TECH RESEARCH CORPORATION (US) 2013-04-25 — — US disclosed
WO-2013023106-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (ACYL MOIETIES) GEORGIA TECH RESEARCH CORPORATION (US) 2013-02-14 — — WO disclosed
WO-2013023107-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (ELECTRON WITHDRAWING GROUPS) GEORGIA TECH RESEARCH CORPORATION (US) 2013-02-14 — — WO disclosed
WO-2013023109-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (COUPLED TRICYCLIC CORE COMPOUNDS) GEORGIA TECH RESEARCH CORPORATION (US) 2013-02-14 — — WO disclosed
WO-2013023108-A1 COUPLED HETEROARYL COMPOUNDS VIA REARRANGEMENT OF HALOGENATED HETEROAROMATICS FOLLOWED BY OXIDATIVE COUPLING (HETEROARYLENE SPACER MOIETY) GEORGIA TECH RESEARCH CORPORATION (US) 2013-02-14 — — WO disclosed
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