SCHEMBL23351580

SCHEMBL23351580

CC1(C)c2ccccc2-c2cc3c(cc21)-c1ccc(-c2cc4c(c5c2oc2ccccc25)-c2cc5c(cc2C4(C)C)-c2c(cc(-c4ccc6c(c4)C(C)(C)c4cc7c(cc4-6)C(C)(C)c4ccccc4-7)c4oc6ccccc6c24)C5(C)C)cc1C3(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.36
▸ ALK Q9UM73 6/20 0.33
▸ CDC14B O60729 2/20 0.33
▸ CDC14A Q9UNH5 2/20 0.33
▸ PGR P06401 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ALPI P09923 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ CASP6 P55212 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MCL1 Q07820 1/20 0.32

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
SCHEMBL20205371 0.99 ALOX5 (0.37) ALOX5ALKCDC14BCDC14APGR
SCHEMBL21533728 0.97 ALOX5 (0.34) ALOX5ALKCDC14BCDC14APGR
SCHEMBL20205294 0.96 ALOX5 (0.34) ALOX5ALKCDC14BCDC14A
SCHEMBL20205646 0.95 ALOX5 (0.36) ALOX5ALKCDC14BCDC14APGR
SCHEMBL21533729 0.95 ALOX5 (0.33) ALOX5ALKCDC14BCDC14APDK2
SCHEMBL20205546 0.94 ALOX5 (0.37) ALOX5ALKCDC14BCDC14AKDM4E
SCHEMBL20205293 0.94 ALOX5 (0.34) ALOX5ALKCDC14BCDC14APGR
SCHEMBL20205645 0.93 ALOX5 (0.34) ALOX5ALKCDC14BCDC14A
SCHEMBL20205729 0.93 ALOX5 (0.38) ALOX5ALKCDC14BCDC14AKDM4E
SCHEMBL24649780 0.93 ALOX5 (0.35) ALOX5ALKCDC14BCDC14APGR

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 1 patent. 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
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