SCHEMBL29068782

SCHEMBL29068782

CCCC=CCC=CCCCCCCCc1ccc(C(C)(C)C)c(O)c1C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.42
F3 P13726 3/20 0.42
HIF1A Q16665 1/20 0.40
EPAS1 Q99814 1/20 0.40
BID P55957 3/20 0.38
BCL2L1 Q07817 3/20 0.38
MCL1 Q07820 3/20 0.38
BAK1 Q16611 3/20 0.38
MMP2 P08253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
ECE1 P42892 1/20 0.38
SGMS1 Q86VZ5 1/20 0.38
SGMS2 Q8NHU3 1/20 0.38
MUS81 Q96NY9 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
TYR P14679 1/20 0.35
EPHX2 P34913 1/20 0.34

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
SCHEMBL29068772 0.92 F7 (0.45) F7F3BIDBCL2L1MCL1
SCHEMBL26482857 0.86 F7 (0.41) F7F3HIF1AEPAS1BID
SCHEMBL26482848 0.84 F7 (0.45) F7F3HIF1AEPAS1BID
SCHEMBL1846556 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL6897662 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL30816147 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL28307750 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL3709017 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL29170685 0.83 TYR (0.49) HIF1ABIDBCL2L1MCL1BAK1
SCHEMBL29068781 0.81 USP2 (0.38) TYR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403618-B 2, 6-Di-tert-butylphenol compound and preparation method and application thereof 江西苏克尔新材料有限公司 2025-03-21 CN disclosed
CN-115418264-B Refrigerator oil composition and preparation method and application thereof 江西苏克尔新材料有限公司 2023-09-12 CN disclosed
CN-115418264-A Refrigerating machine oil composition and preparation method and application thereof 江西苏克尔新材料有限公司 2022-12-02 CN disclosed
CN-115403618-A 2, 6-di-tert-butyl phenol compound and preparation method and application thereof 江西苏克尔新材料有限公司 2022-11-29 CN disclosed