SCHEMBL28334456

SCHEMBL28334456

CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(C)C3CC[C@H]4C(C)(C)C(O)CC(C(=O)O)[C@]4(C)C3CC[C@]12C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EBP Q15125 7/20 0.47
▸ HMGCR P04035 2/20 0.43
▸ FNTA P49354 1/20 0.43
▸ FNTB P49356 1/20 0.43
▸ NPC1L1 Q9UHC9 3/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ACLY P53396 2/20 0.41
▸ ACACA Q13085 2/20 0.41
▸ CDC25A P30304 4/20 0.40
▸ CDC25B P30305 2/20 0.39

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
SCHEMBL29275435 0.79 EBP (0.47) EBPHMGCRFNTAFNTBNPC1L1
SCHEMBL28831684 0.79 HMGCR (0.54) EBPHMGCRNPC1L1MEN1USP2
SCHEMBL28926182 0.74 EBP (0.48) EBPNPC1L1MEN1USP2LMNA
SCHEMBL17583234 0.73 EBP (0.43) EBPHMGCRFNTAFNTBNPC1L1
SCHEMBL9766747 0.72 HMGCR (0.49) EBPHMGCRFNTAFNTBNPC1L1
SCHEMBL9766753 0.72 HMGCR (0.49) EBPHMGCRFNTAFNTBNPC1L1
SCHEMBL17583233 0.71 CDC25A (0.43) EBPHMGCRFNTAFNTBNPC1L1
SCHEMBL4105049 0.71 PTGS2 (0.47) EBPHMGCRNPC1L1LMNAACLY
SCHEMBL332666 0.71 CDC25A (0.51) EBPNPC1L1MEN1USP2LMNA
SCHEMBL29398347 0.71 CDC25A (0.51) EBPNPC1L1MEN1USP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110548089-A A Chinese medicinal composition for stopping smoking SONG WENXIANG 2019-12-10 — — CN claimed
CN-114392323-A Anti-glycation traditional Chinese medicine extract 上海家化联合股份有限公司 2022-04-26 — — CN disclosed
CN-113951304-A Biscuit containing carotene, hawthorn, sea buckthorn and poria cocos and using method 赵志库 2022-01-21 — — CN disclosed
CN-113908087-A Natural moisturizing combined extract, preparation method and application thereof 广州臻颜化妆品有限公司 2022-01-11 — — CN disclosed
CN-113841884-A Formula of instant meal replacement powder for improving nutrient metabolism and preparation method thereof 湖南袁氏农牧科技发展有限公司 2021-12-28 — — CN disclosed
CN-112656737-A Plant acne-removing composition, preparation and preparation method thereof 赵如意 2021-04-16 — — CN disclosed
CN-112220739-A HPV virus inactivation dressing and preparation method thereof 国润生物科技(深圳)有限公司 2021-01-15 — — CN disclosed
CN-110548089-A A Chinese medicinal composition for stopping smoking SONG WENXIANG 2019-12-10 — — CN disclosed
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