SCHEMBL29551597

SCHEMBL29551597

C=C/C(C)=C/C[C@H]1[C@](C)(O)[C@@H](O)[C@@H](O)C2C(C)(C)CCC[C@@]21C

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 3/20 0.34
TP53 P04637 2/20 0.34
MAPK1 P28482 2/20 0.34
TRPC6 Q9Y210 1/20 0.34
ALOX15 P16050 1/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TRPA1 O75762 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.31
UGT2B7 P16662 1/20 0.30

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
SCHEMBL29922526 1.00 MAPT (0.40) MAPTPOLBCYP3A4TP53MAPK1
SCHEMBL8731622 1.00 MAPT (0.40) MAPTPOLBCYP3A4TP53MAPK1
SCHEMBL30498603 0.83 MAPT (0.41) MAPTPOLBCYP3A4TP53MAPK1
SCHEMBL30498601 0.83 MAPT (0.38) MAPTPOLBCYP3A4TP53MAPK1
SCHEMBL8733660 0.80 TTL (0.39) MAPTPOLBCYP3A4TP53MAPK1
SCHEMBL8731624 0.77 MAPT (0.40) MAPTPOLBCYP3A4MEN1KMT2A
SCHEMBL8731628 0.71 ALDH1A1 (0.57) MAPTPOLBCYP3A4MEN1KMT2A
SCHEMBL18089046 0.71 ALDH1A1 (0.57) MAPTPOLBCYP3A4MEN1KMT2A
SCHEMBL9549996 0.71 ALDH1A1 (0.57) MAPTPOLBCYP3A4MEN1KMT2A
SCHEMBL15220009 0.71 ALDH1A1 (0.57) MAPTPOLBCYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119923399-A Useful as matrix metalloproteinase inhibitors diazabicyclooctane derivatives of (a) 瓦萨治疗有限责任公司 2025-05-02 CN disclosed
CN-119731179-A IKZF2 degradation agent and application thereof 密歇根大学董事会 2025-03-28 CN disclosed
CN-119630656-A Heterocyclic compounds for inducing cleavage of mutant KRAS proteins 安斯泰来制药株式会社 2025-03-14 CN disclosed
CN-119433222-A Recovery method and recovery device for metal in photovoltaic module welding strip 天合光能股份有限公司 2025-02-14 CN disclosed
CN-113307772-B Human plasma kallikrein inhibitors 拜奥克里斯特制药公司 2024-06-28 CN disclosed
CN-115181092-B Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2024-05-03 CN disclosed
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 CN disclosed
CN-117320715-A Compounds for the treatment of hyperproliferative diseases 瓦尔希伯伦私人肿瘤研究基金会 2023-12-29 CN disclosed
CN-117042759-A IL-31 production inhibitor and pharmaceutical composition containing the same 国立大学法人九州大学 2023-11-10 CN disclosed
CN-116888101-A Substituted isoxazoline derivatives 巴斯夫欧洲公司 2023-10-13 CN disclosed
CN-116018344-A Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达农作物保护股份公司 2023-04-25 CN disclosed
CN-110271331-B Pressure-sensitive transfer printing correction tape 株式会社蜻蜓铅笔 2022-11-08 CN disclosed
CN-114591302-B Compounds and methods for preparing compounds 北京远大九和药业有限公司 2022-10-28 CN disclosed
WO-2022215387-A1 HYDROPONIC CULTIVATION METHOD 国立研究開発法人農業・食品産業技術総合研究機構 2022-10-13 WO disclosed
CN-112279837-B Pyrazine compounds and uses thereof 迪哲(江苏)医药股份有限公司 2022-08-09 CN disclosed
CN-114787159-A BRM targeting compounds and related methods of use 阿尔维纳斯运营股份有限公司 2022-07-22 CN disclosed
CN-110204544-B 2- (morpholin-4-yl) -1, 7-naphthyridine 拜耳制药股份公司 2022-04-12 CN disclosed
CN-110088103-B Novel tetrahydropyridopyrimidine compounds for the treatment and prophylaxis of hepatitis b virus infection 豪夫迈·罗氏有限公司 2022-04-12 CN disclosed