SCHEMBL28423903

SCHEMBL28423903

CCCCCCCC[Sn+2]CCCCCCCC.O=C([O-])C(S)S.O=C([O-])C(S)S

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.46
CA1 P00915 2/20 0.44
CES2 O00748 4/20 0.41
CES1 P23141 4/20 0.41
GPR84 Q9NQS5 3/20 0.38
HAO1 Q9UJM8 1/20 0.37
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
FABP3 P05413 2/20 0.36
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
TLR2 O60603 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
1,4-Butanediol SCHEMBL13735607 0.93 TSHR (0.45) CA2CA1CES2CES1KMT2A
SCHEMBL9856766 0.92 CA1 (0.42) CA2CA1CES2CES1TSHR
Ethylene Glycol SCHEMBL11603063 0.86 CA1 (0.38) CA2CA1CES2CES1ALDH1A1
Ethylene Glycol SCHEMBL11603058 0.86 CA1 (0.38) CA2CA1CES2CES1ALDH1A1
SCHEMBL11037177 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84
SCHEMBL11766377 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84
SCHEMBL11012005 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84
SCHEMBL8778100 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84
SCHEMBL11734687 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84
SCHEMBL11828676 0.85 CA2 (0.49) CA2CA1CES2CES1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119998349-A Two-component polyurethane for polycarbonate bonding 阿科玛法国 2025-05-13 CN claimed
CN-119529216-A Tear-resistant functional chain extender, preparation and application thereof in tear-resistant polyurethane 广州秀珀化工涂料有限公司 2025-02-28 CN claimed
CN-119463111-A Ultralow-hardness polyurethane gel and preparation method thereof 聚力和成新材料(江苏)有限公司 2025-02-18 CN claimed
CN-119060678-A Single-component polyurethane adhesive, preparation method and application thereof 江苏长顺高分子材料研究院有限公司 2024-12-03 CN claimed
CN-116874714-B Polyurethane foaming tyre with low hysteresis loss and preparation method thereof 山东一诺威新材料有限公司 2023-12-12 CN claimed
CN-116874714-A Polyurethane foaming tyre with low hysteresis loss and preparation method thereof 山东一诺威新材料有限公司 2023-10-13 CN claimed
CN-108504069-B Glass fiber toughened polycarbonate material 宁波坚锋新材料有限公司 2020-06-26 CN claimed
CN-119979100-A Retroreflective articles containing polyether polyester polyurethane binder layers and uses thereof 盛圣(天津)新材料科技有限公司 2025-05-13 CN disclosed
CN-119998349-A Two-component polyurethane for polycarbonate bonding 阿科玛法国 2025-05-13 CN disclosed
CN-119529216-A Tear-resistant functional chain extender, preparation and application thereof in tear-resistant polyurethane 广州秀珀化工涂料有限公司 2025-02-28 CN disclosed
CN-119463111-A Ultralow-hardness polyurethane gel and preparation method thereof 聚力和成新材料(江苏)有限公司 2025-02-18 CN disclosed
CN-119331205-A Hard polyurethane electronic foam with high aperture ratio and preparation method thereof 湖北祥源新材科技股份有限公司 2025-01-21 CN disclosed
CN-119060678-A Single-component polyurethane adhesive, preparation method and application thereof 江苏长顺高分子材料研究院有限公司 2024-12-03 CN disclosed
WO-2024235233-A1 BIO-BASED TRANS-ACONITATE, PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院青岛生物能源与过程研究所 2024-11-21 WO disclosed
CN-116874714-B Polyurethane foaming tyre with low hysteresis loss and preparation method thereof 山东一诺威新材料有限公司 2023-12-12 CN disclosed
CN-116874714-A Polyurethane foaming tyre with low hysteresis loss and preparation method thereof 山东一诺威新材料有限公司 2023-10-13 CN disclosed
CN-109206570-B Flexible physical split-phase supermolecular dynamic polymer and application thereof 厦门天策材料科技有限公司 2023-04-25 CN disclosed
CN-111155325-B Three-dimensional composite nano carbon material, environment-friendly polyurethane synthetic leather with high folding fastness prepared from three-dimensional composite nano carbon material and preparation method of environment-friendly polyurethane synthetic leather 黎明化工研究设计院有限责任公司 2022-08-30 CN disclosed
CN-109322167-B Special film material for tent 宁波天盾防水材料有限公司 2021-09-14 CN disclosed