SCHEMBL137714

SCHEMBL137714

C[CH]c1ccc(C)cc1

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
SCHEMBL2187090 0.86 ALDH1A1 (0.38)
SCHEMBL1149391 0.76 CYP2A6 (0.58)
(E)-1,2-Di-P-Tolylethene SCHEMBL6480905 0.76 CYP2A6 (0.58)
(E)-1,2-Di-P-Tolylethene SCHEMBL1305580 0.76 NFE2L2 (0.74)
(E)-1,2-Di-P-Tolylethene SCHEMBL1305582 0.76 NFE2L2 (0.74)
SCHEMBL318785 0.76 NFE2L2 (0.74)
(E)-1,2-Di-P-Tolylethene SCHEMBL1793692 0.76 NFE2L2 (0.74)
SCHEMBL318786 0.76 NFE2L2 (0.74)
SCHEMBL272756 0.75 NFE2L2 (0.56)
SCHEMBL272755 0.75 NFE2L2 (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207253-A1 Inhibitors of CDR1 for Reversal of Azole Drug Resistance in Fungal Infections THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2024-06-27 US claimed
CN-118084786-A Schiff base compound, preparation method and application thereof 安徽省东超科技有限公司 2024-05-28 CN claimed
CN-117799197-A Large-area electrochromic device and preparation method thereof 绍兴百立盛新材料科技有限公司 2024-04-02 CN claimed
CN-114901702-B Glycosaminoglycan derivative and application thereof 深圳市海普瑞药业集团股份有限公司 2024-01-09 CN claimed
US-20230131260-A1 SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 US claimed
WO-2022245951-A1 INHIBITORS OF CDR1 FOR REVERSAL OF AZOLE DRUG RESISTANCE IN FUNGAL INFECTIONS UNM RAINFOREST INNOVATIONS (US) 2022-11-24 WO claimed
CN-111212833-B Phenylpyridine derivatives and pharmaceutical compositions containing the same 株式会社大熊制药 2022-09-06 CN claimed
CN-114901702-A Glycosaminoglycan derivative and application thereof 深圳市海普瑞药业集团股份有限公司 2022-08-12 CN claimed
EP-3696176-B1 NOVEL PHENYLPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME DAE WOONG PHARMA (KR) 2022-05-04 EP claimed
US-11274083-B2 Substituted thiophenyl uracils, salts thereof and the use thereof as herbicidal agents SYNGENTA CROP PROTECTION AG (CH) 2022-03-15 US claimed
EP-0357559-B1 Aqueous formulations and their use HOECHST AG (DE) 1994-10-19 EP claimed
EP-0382138-B1 Auxiliary mixture and its use in dyeing synthetic fibrous materials CIBA GEIGY AG (CH) 1994-08-24 EP claimed
EP-0576484-A1 FUNGICIDAL FORMULATIONS. HOECHST AG (DE) 1994-01-05 EP claimed
EP-0279239-B1 MICROBICIDES CIBA-GEIGY AG (CH) 1992-11-11 EP claimed
WO-1992016105-A1 FUNGICIDAL FORMULATIONS SCHERING AGROCHEMICALS LIMITED (GB) 1992-10-01 WO claimed
EP-0505053-A1 Fungicidal formulations AgrEvo UK Limited (GB) 1992-09-23 EP claimed
US-5009668-A Mixture of assistants and its use in the dyeing of synthetic fibre materials: acid ester of oxyalkylated phendl, nonionic surfactant and dye carrier CIBA-GEIGY CORPORATION (US) 1991-04-23 US claimed
EP-0414631-A1 Auxiliary agent mixture and its use in dyeing polyester fibre materials CIBA-GEIGY AG (CH) 1991-02-27 EP claimed
EP-0382138-A1 Auxiliary mixture and its use in dyeing synthetic fibrous materials CIBA-GEIGY AG (CH) 1990-08-16 EP claimed
EP-0357559-A2 Aqueous formulations and their use AgrEvo UK Limited (GB) 1990-03-07 EP claimed