SCHEMBL27013232

SCHEMBL27013232

c1ccc(-c2ccc(-c3ccc4ccc5c(-c6cccc7ccccc67)ccc6ccc3c4c65)c3c2oc2ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 2/20 0.44
CDC14A Q9UNH5 2/20 0.44
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
CYP19A1 P11511 2/20 0.38
CYP17A1 P05093 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
ALOX5 P09917 2/20 0.38
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 4/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 4/20 0.38
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 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
SCHEMBL27013093 0.96 TDP1 (0.41) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013062 0.94 CDC14B (0.46) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013190 0.92 CDC14B (0.39) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013073 0.92 CDC14B (0.39) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013192 0.92 CDC14B (0.48) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013096 0.92 CDC14B (0.48) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013186 0.89 CDC14B (0.44) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013082 0.88 ALOX5 (0.38) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013052 0.88 CDC14B (0.40) CDC14BCDC14ATDP1L3MBTL1CYP19A1
SCHEMBL27013235 0.87 ALDH1A1 (0.40) TDP1L3MBTL1CYP19A1ALDH1A1KDM4E

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
US-20240023359-A1 ORGANIC LIGHT-EMITTING DEVICE COMPRISING NOVEL ORGANIC COMPOUND IN EMISSION LAYER SFC CO., LTD. (KR) 2024-01-18 US disclosed