SCHEMBL27451632

SCHEMBL27451632

CC(C)(O)C(C)(C)OBc1cccc2oc3c(-c4ccc(-c5ccccc5)cc4)cccc3c12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.38
▸ CDC14B O60729 2/20 0.36
▸ CDC14A Q9UNH5 2/20 0.36
▸ GGPS1 O95749 1/20 0.35
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ PPARD Q03181 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ ADRB2 P07550 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
SCHEMBL27451857 0.98 CDC14B (0.37) ALOX5CDC14BCDC14AGGPS1CYP2C9
SCHEMBL27451634 0.94 ALOX5 (0.39) ALOX5CDC14BCDC14AGGPS1
SCHEMBL27452430 0.90 ALOX5 (0.39) ALOX5CDC14BCDC14AGGPS1ADRB2
SCHEMBL23098310 0.89 CDC14B (0.32) ALOX5CDC14BCDC14AGGPS1
SCHEMBL22763999 0.89 CDC14B (0.35) ALOX5CDC14BCDC14AGGPS1CYP2C9
SCHEMBL27451243 0.88 CDC14B (0.44) ALOX5CDC14BCDC14AGGPS1ADRB2
SCHEMBL21319077 0.87 ALOX5 (0.34) ALOX5GGPS1CYP2C9CYP2C19PPARG
SCHEMBL23033833 0.87 CDC14B (0.34) ALOX5CDC14BCDC14AGGPS1CYP2C19
SCHEMBL27452428 0.85 ALOX5 (0.47) ALOX5CDC14BCDC14AGGPS1CYP2C19
SCHEMBL27451914 0.85 GGPS1 (0.34) ALOX5CDC14BCDC14AGGPS1CYP2C9

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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