SCHEMBL29466752

SCHEMBL29466752

CCC(=O)OC[C@H]1O[C@H](OC(=O)CC)[C@H](OC(=O)CC)[C@@H](OC(=O)CC)[C@@H]1OC(=O)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ ANTXR2 P58335 3/20 0.42
▸ CA2 P00918 6/20 0.42
▸ CA1 P00915 5/20 0.42
▸ CA12 O43570 4/20 0.42
▸ CA9 Q16790 4/20 0.42
▸ CA14 Q9ULX7 4/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PTPN1 P18031 1/20 0.40
▸ FYN P06241 2/20 0.40
▸ NR3C1 P04150 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ ADRA2B P18089 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ TMPRSS2 O15393 1/20 0.39
▸ USP2 O75604 1/20 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
SCHEMBL5533141 1.00 CYP2D6 (0.47) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL19090500 0.98 CYP2D6 (0.44) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL17326907 0.98 CYP2D6 (0.44) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL29525898 0.94 ANTXR2 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL29774502 0.94 ANTXR2 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL23651803 0.94 ANTXR2 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL269962 0.94 ANTXR2 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL23651823 0.92 CYP2D6 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL24105675 0.92 CYP2D6 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2
SCHEMBL270320 0.92 CYP2D6 (0.46) CYP2D6THRBHSD17B10ANTXR2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119452026-A Cellulose ester polymer compositions having low coefficient of friction 乐高公司 2025-02-14 — — CN disclosed
CN-117700565-A Recovery of component cellulose esters 伊士曼化工公司 2024-03-15 — — CN disclosed
CN-114072429-B Recovery of component cellulose esters 伊士曼化工公司 2023-12-26 — — CN disclosed
CN-117178017-A Ophthalmic articles having high toughness and dimensional stability made from cellulose ester compositions 伊士曼化工公司 2023-12-05 — — CN disclosed
CN-110168005-B Cellulose ester and impact modifier compositions and articles made using these compositions 伊士曼化工公司 2023-07-28 — — CN disclosed
CN-110168004-B Polymer-based resin compositions derived from cellulose and articles made using these compositions 伊士曼化工公司 2023-07-18 — — CN disclosed
CN-111684004-B Cellulose esters and polymeric aliphatic polyester compositions and articles 伊士曼化工公司 2023-06-27 — — CN disclosed
CN-110168006-B Cellulose ester and ethylene-vinyl acetate compositions and articles made using these compositions 伊士曼化工公司 2023-04-11 — — CN disclosed
CN-110168007-B Polymer-based resin compositions derived from cellulose and articles made using these compositions 伊士曼化工公司 2023-04-04 — — CN disclosed
CN-111684005-B Cellulose esters and polymerized aliphatic polyester compositions and articles 伊士曼化工公司 2022-10-28 — — CN disclosed
CN-115244086-A Low hydroxyl content cellulose esters and polymeric aliphatic polyester compositions and articles 伊士曼化工公司 2022-10-25 — — CN disclosed
CN-114981350-A Molded articles for use with terpene-containing oils 伊士曼化工公司 2022-08-30 — — CN disclosed
CN-114072429-A Recovery of constituent cellulose ester 伊士曼化工公司 2022-02-18 — — CN disclosed
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