SCHEMBL20205712

SCHEMBL20205712

CC1(C)c2cc3c(cc2-c2c1cc(-c1cccc4ccccc14)c1c2oc2ccccc21)C(C)(C)c1cc(-c2cccc4ccccc24)c2oc4ccccc4c2c1-3

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ PGR P06401 1/20 0.33
▸ GPR84 Q9NQS5 1/20 0.32
▸ ALOX5 P09917 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.31
▸ HPGD P15428 3/20 0.31
▸ HSD17B10 Q99714 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL24649647 0.96 MAOA (0.32) MAOAMAOBPGRGPR84ALOX5
SCHEMBL23351763 0.95 MAOA (0.36) MAOAMAOBPGRGPR84ALOX5
SCHEMBL20205469 0.95 MAOA (0.36) MAOAMAOBPGRGPR84ALOX5
SCHEMBL20205449 0.94 ALOX5 (0.36) MAOAMAOBPGRGPR84ALOX5
SCHEMBL20205630 0.94 ALOX5 (0.36) MAOAMAOBPGRGPR84ALOX5
SCHEMBL23351967 0.92 ALOX5 (0.33) MAOAMAOBPGRGPR84ALOX5
SCHEMBL20205312 0.90 ENPP3 (0.34) ALOX5
SCHEMBL24649901 0.87 ALOX5 (0.36) MAOAMAOBPGRALOX5TDP1
SCHEMBL20205321 0.87 CDC14B (0.35) PGRALOX5HPGDMAPTMEN1
SCHEMBL24649891 0.87 CDC14B (0.37) PGRHPGDMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3544985-B1 BISBENZOFURAN-FUSED INDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2021-05-12 — — EP disclosed
WO-2018095940-A1 BISBENZOFURAN-FUSED INDENO[1,2-B]FLUORENE DERIVATIVES AND RELATED COMPOUNDS AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES (OLED) MERCK PATENT GMBH (DE) 2018-05-31 — — WO disclosed
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