SCHEMBL19011041

SCHEMBL19011041

Cc1ccc(-c2ccc(-c3ccccc3)c3oc4ccccc4c23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC14B O60729 2/20 0.50
▸ CDC14A Q9UNH5 2/20 0.50
▸ MAOB P27338 2/20 0.45
▸ TNKS O95271 1/20 0.45
▸ PARP1 P09874 1/20 0.45
▸ TNKS2 Q9H2K2 1/20 0.45
▸ PARP2 Q9UGN5 1/20 0.45
▸ HTT P42858 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ RET P07949 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ NPC1 O15118 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ NFKB1 P19838 1/20 0.42

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
SCHEMBL19011039 1.00 CDC14B (0.50) CDC14BCDC14AMAOBTNKSPARP1
SCHEMBL12203192 0.90 CDC14B (0.57) CDC14BCDC14AMAOBTNKSPARP1
SCHEMBL23543020 0.86 TDP1 (0.44) CDC14BCDC14AMAOBTNKSPARP1
SCHEMBL19011035 0.86 CDC14B (0.47) CDC14BCDC14AMAOBTP53TSHR
SCHEMBL19011042 0.86 CDC14B (0.47) CDC14BCDC14AMAOBTP53TSHR
SCHEMBL19010947 0.86 ALOX5 (0.46) CDC14BCDC14AMAOBTNKSPARP1
SCHEMBL18382914 0.85 CDC14B (0.51) CDC14BCDC14ATNKSPARP1TNKS2
SCHEMBL16283902 0.85 CDC14B (0.48) CDC14BCDC14ATNKSPARP1TNKS2
SCHEMBL20462447 0.84 CDC14B (0.50) CDC14BCDC14AMAOBTNKSPARP1
SCHEMBL25907810 0.84 CDC14B (0.50) CDC14BCDC14AMAOBTNKSPARP1

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
WO-2017102064-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-06-22 — — WO disclosed
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