SCHEMBL27451857

SCHEMBL27451857

CC(C)(O)C(C)(C)OBc1cccc2oc3c(-c4ccccc4)cccc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC14B O60729 2/20 0.37
▸ CDC14A Q9UNH5 2/20 0.37
▸ GGPS1 O95749 1/20 0.36
▸ ALOX5 P09917 2/20 0.36
▸ ADRB2 P07550 1/20 0.31
▸ PRKDC P78527 2/20 0.31
▸ PTGES2 Q9H7Z7 1/20 0.30
▸ PIK3CD O00329 2/20 0.30
▸ PIK3CA P42336 2/20 0.30
▸ PIK3CB P42338 2/20 0.30
▸ PIK3CG P48736 2/20 0.30
▸ CYP2C9 P11712 2/20 0.30
▸ CYP2C19 P33261 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ PDE2A O00408 1/20 0.30
▸ PIK3C2A O00443 1/20 0.30
▸ PIK3R2 O00459 1/20 0.30
▸ PIK3C2B O00750 1/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ PDE5A O76074 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
SCHEMBL27451632 0.98 ALOX5 (0.38) CDC14BCDC14AGGPS1ALOX5ADRB2
SCHEMBL27451634 0.93 ALOX5 (0.39) CDC14BCDC14AGGPS1ALOX5PRKDC
SCHEMBL22763999 0.91 CDC14B (0.35) CDC14BCDC14AGGPS1ALOX5CYP2C9
SCHEMBL27452430 0.90 ALOX5 (0.39) CDC14BCDC14AGGPS1ALOX5ADRB2
SCHEMBL23033833 0.89 CDC14B (0.34) CDC14BCDC14AGGPS1ALOX5CYP2C19
SCHEMBL23098310 0.89 CDC14B (0.32) CDC14BCDC14AGGPS1ALOX5KDM4E
SCHEMBL27451914 0.87 GGPS1 (0.34) CDC14BCDC14AGGPS1ALOX5ADRB2
SCHEMBL22884331 0.85 ADRB2 (0.32) ADRB2
SCHEMBL27451243 0.85 CDC14B (0.44) CDC14BCDC14AGGPS1ALOX5ADRB2
SCHEMBL27452428 0.85 ALOX5 (0.47) CDC14BCDC14AGGPS1ALOX5ADRB2

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-2024144086-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-07-04 — — WO disclosed
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