SCHEMBL28218362

SCHEMBL28218362

CCCCC[C@H](O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.61
▸ RIPK1 Q13546 1/20 0.57
▸ KDM4E B2RXH2 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ ASAH1 Q13510 1/20 0.54
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ CSNK1E P49674 1/20 0.50
▸ NAAA Q02083 2/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CERT1 Q9Y5P4 3/20 0.48
▸ AOC3 Q16853 2/20 0.47

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
SCHEMBL317208 1.00 LMNA (0.61) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL477511 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL405975 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL30975296 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL477546 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL477567 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL477608 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL7120698 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL22491606 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1
SCHEMBL477578 0.98 LMNA (0.59) LMNARIPK1KDM4EALDH1A1ASAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110002961-B Method for racemization-free synthesis of chiral alcohol 三峡大学 2022-05-03 — — CN disclosed
CN-108101740-B Method for directly converting aromatic alkyne into chiral alcohol by one-pot method 三峡大学 2022-02-01 — — CN disclosed
CN-108101741-B Method for synthesizing chiral alcohol by alkyne hydration/asymmetric hydrogenation tandem 三峡大学 2021-06-29 — — CN disclosed
CN-108101741-A A kind of method of alkynes hydration/asymmetric hydrogenation series connection synthesis of chiral alcohol 三峡大学 2018-06-01 — — CN disclosed
CN-108101740-A A kind of method that fragrance alkynes one kettle way is directly translated into chiral alcohol 三峡大学 2018-06-01 — — CN disclosed
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