SCHEMBL28525740

SCHEMBL28525740

Nc1ccc(Br)c2oc3ccccc3c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 1/20 0.51
CDC14A Q9UNH5 1/20 0.51
NQO1 P15559 1/20 0.42
CYP19A1 P11511 3/20 0.40
CYP17A1 P05093 2/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
LIMK1 P53667 1/20 0.40
ALDH1A1 P00352 7/20 0.38
KDM4E B2RXH2 6/20 0.38
MAPT P10636 5/20 0.38
HPGD P15428 5/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
GAA P10253 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL18382949 0.86 CDC14B (0.44) CDC14BCDC14ANQO1CYP19A1CYP17A1
SCHEMBL17253012 0.85 CDC14B (0.56) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL3875085 0.85 NQO1 (0.47) CDC14BCDC14ANQO1CYP19A1CYP17A1
SCHEMBL30152055 0.85 CDC14B (0.56) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL24157305 0.79 CDC14B (0.51) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL21343384 0.79 KDM5A (0.56) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL22315997 0.79 CDC14B (0.51) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL22141187 0.79 CDC14B (0.51) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL29819612 0.79 CDC14B (0.51) CDC14BCDC14ACYP19A1CYP17A1CYP11B1
SCHEMBL30394680 0.79 CDC14B (0.51) CDC14BCDC14ACYP19A1CYP17A1CYP11B1

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
CN-106928237-B N-heterodicarbazole compound, preparation method, intermediate and application thereof, and organic electroluminescent device 北京绿人科技有限责任公司 2020-12-29 CN disclosed