SCHEMBL10172

SCHEMBL10172

C#C[CH]C#CC

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9161853 0.76
SCHEMBL145443 0.66
SCHEMBL2310129 0.64
SCHEMBL6084247 0.62
SCHEMBL1741550 0.61
Ethyne SCHEMBL432671 0.57
SCHEMBL23667 0.56
SCHEMBL28283259 0.55
Propyne SCHEMBL1330783 0.55
Propyne SCHEMBL9522893 0.55

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 420 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111217811-A Fused tricyclic compound and application thereof in medicines 广东东阳光药业有限公司 2020-06-02 CN claimed
EP-1266015-B1 ECDYSONE RECEPTOR-BASED INDUCIBLE GENE EXPRESSION SYSTEM RHEOGENE HOLDINGS INC (US) 2006-08-30 EP claimed
CN-118234377-A Method for improving efficacy of herbicides 巴斯夫欧洲公司 2024-06-21 CN disclosed
US-11964938-B2 3-phenyl-4-hexynoic acid derivatives as GPR40 agonists CELON PHARMA S.A. (PL) 2024-04-23 US disclosed
EP-3737470-B9 3-PHENYL-4-HEXYNOIC ACID DERIVATIVES AS GPR40 AGONISTS Celon Pharma Sa (PL) 2024-03-13 EP disclosed
WO-2023238835-A1 SILSESQUIOXANE DERIVATIVE AND METHOD FOR PRODUCING SAME, CURABLE COMPOSITION, HARD COAT AGENT, CURED PRODUCT, HARD COAT, AND BASE MATERIAL 東亞合成株式会社 2023-12-14 WO disclosed
EP-4288776-A1 COMPOSITIONS AND METHODS FOR PREVENTING NON-SPECIFIC INTERACTIONS BETWEEN POLYMER DYES-ANTIBODY CONJUGATES Beckman Coulter, Inc. (US) 2023-12-13 EP disclosed
WO-2023230649-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-12-07 WO disclosed
CN-117043140-A Substituted pyrrolidin-2-ones, salts thereof and their use as herbicidal active substances 拜耳公司 2023-11-10 CN disclosed
WO-2023164678-A1 AQUEOUS BASED POLYMERS FOR SILICON ANODES ENEVATE CORPORATION (US) 2023-08-31 WO disclosed
WO-2023115166-A1 COMPOUNDS Psylo Pty Ltd (AU) 2023-06-29 WO disclosed
WO-2003031422-A1 NOVEL BENZOTHIAZINE DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2003-04-17 WO disclosed
EP-1301514-A1 ARYL AND HETEROARYL DIAZABICYCLOALKANES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2003-04-16 EP disclosed
US-6545021-B1 Including ether and ester derivatives as well as N-carbonyl derivatives G.D. SEARLE & CO. 2003-04-08 US disclosed
WO-2003004493-A1 NOVEL COMPOUNDS, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2003-01-16 WO disclosed
WO-2003004010-A1 CARBONYLAMINO DERIVATIVES USEFUL FOR OBTAINING IMMUNE REGULATION POSEIDON PHARMACEUTICALS A/S (DK) 2003-01-16 WO disclosed
WO-2003000696-A1 COMBINATION THERAPY OF AN SODm AND A CORTICOSTEROID FOR PREVENTION AND/OR TREATMENT OF INFLAMMATORY DISEASE METAPHORE PHARMACEUTICALS, INC. (US) 2003-01-03 WO disclosed
EP-1185312-A2 BIOMATERIALS MODIFIED WITH SUPEROXIDE DISMUTASE MIMICS MONSANTO COMPANY (US) 2002-03-13 EP disclosed
WO-2002002564-A1 ARYL AND HETEROARYL DIAZABICYCLOALKANES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 2002-01-10 WO disclosed
WO-2000072893-A2 BIOMATERIALS MODIFIED WITH SUPEROXIDE DISMUTASE MIMICS MONSANTO COMPANY (US) 2000-12-07 WO disclosed