SCHEMBL20320243

SCHEMBL20320243

Brc1ccc(N(c2ccc(Br)cc2)c2ccc(-c3ccc4c(c3)CC4)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 2/20 0.39
▸ ADCY8 P40145 1/20 0.36
▸ ADCY1 Q08828 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ PNMT P11086 1/20 0.34
▸ ASIC3 Q9UHC3 1/20 0.34
▸ CYP11B1 P15538 2/20 0.34
▸ CYP11B2 P19099 2/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ MELK Q14680 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HSD17B3 P37058 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ HSD17B1 P14061 1/20 0.32
▸ ADORA1 P30542 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
SCHEMBL26429213 0.89 CYP11B1 (0.36) TDP2ADCY8ADCY1ALDH1A1MAPK1
SCHEMBL28282101 0.88 TDP2 (0.46) TDP2ADCY8ADCY1ALDH1A1MAPK1
SCHEMBL2607597 0.86 PNMT (0.37) ADCY8ADCY1ALDH1A1PNMTASIC3
SCHEMBL17841776 0.86 PNMT (0.37) ADCY8ADCY1ALDH1A1PNMTASIC3
SCHEMBL29521410 0.86 PNMT (0.37) ADCY8ADCY1ALDH1A1PNMTASIC3
SCHEMBL14506989 0.86 PNMT (0.37) ADCY8ADCY1ALDH1A1PNMTASIC3
SCHEMBL13837284 0.83 CYP11B1 (0.42) TDP2ASIC3CYP11B1CYP11B2ADRA2A
SCHEMBL12619670 0.81 ADCY8 (0.36) ADCY8ADCY1ALDH1A1ASIC3CYP11B1
SCHEMBL12619835 0.81 ADCY8 (0.36) ADCY8ADCY1ALDH1A1ASIC3CYP11B1
SCHEMBL29308758 0.80 CYP11B1 (0.46) TDP2ADCY8ADCY1ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3559078-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-25 — — EP disclosed
US-20220119590-A1 POLYMERS WITH AMINE-GROUP-CONTAINING REPEATING UNITS MERCK PATENT GMBH (DE) 2022-04-21 — — US disclosed
US-20210277176-A1 FORMULATION CONTAINING A HIGHLY BRANCHED POLYMER, HIGHLY BRANCHED POLYMER AND ELECTRO-OPTICAL DEVICE CONTAINING THIS HIGHLY BRANCHED POLYMER MERCK PATENT GMBH (DE) 2021-09-09 — — US disclosed
WO-2020011701-A1 FORMULATION CONTAINING A HIGHLY BRANCHED POLYMER, HIGHLY BRANCHED POLYMER AND ELECTRO-OPTICAL DEVICE CONTAINING THIS HIGHLY BRANCHED POLYMER MERCK PATENT GMBH (DE) 2020-01-16 — — WO disclosed
US-20190322796-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-10-24 — — US disclosed
WO-2018114882-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-06-28 — — WO disclosed
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