SCHEMBL27451637

SCHEMBL27451637

CC(C)(O)C(C)(C)OBc1ccc2oc3c(-c4ccccc4)cccc3c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
GGPS1 O95749 1/20 0.40
HDAC8 Q9BY41 1/20 0.34
CDC14B O60729 1/20 0.34
CDC14A Q9UNH5 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.33
PRKDC P78527 4/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
ALDH1A1 P00352 3/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31
PIK3CG P48736 2/20 0.31
CYP1A2 P05177 2/20 0.31
KDM4E B2RXH2 2/20 0.31
BRD4 O60885 2/20 0.31

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
SCHEMBL25073022 0.91 ALOX5 (0.44) ALOX5GGPS1HDAC8CDC14BCDC14A
SCHEMBL27452183 0.89 ALOX5 (0.42) ALOX5GGPS1HDAC8PTGES2PRKDC
SCHEMBL22112649 0.88 PRKDC (0.37) ALOX5GGPS1PRKDC
SCHEMBL21965128 0.88 ALOX5 (0.49) ALOX5GGPS1HDAC8CDC14BCDC14A
SCHEMBL24633097 0.87 ALOX5 (0.48) ALOX5GGPS1HDAC8CDC14BCDC14A
SCHEMBL26867634 0.87 ALOX5 (0.36) ALOX5GGPS1CDC14BCDC14APRKDC
SCHEMBL27451752 0.86 HSP90AA1 (0.35) ALDH1A1CYP1A2KDM4ETSHRHSD17B10
SCHEMBL27451690 0.85 WEE1 (0.34) CDC14BCDC14AALDH1A1KDM4ETSHR
SCHEMBL27451754 0.83 WEE1 (0.33)
SCHEMBL27451757 0.83 WEE1 (0.33) ALOX5

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