SCHEMBL57468

SCHEMBL57468

S=[C]Nc1ccccc1

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
SCHEMBL1269895 0.85 ALDH1A1 (0.43)
SCHEMBL11413359 0.84
SCHEMBL27859730 0.79 MGLL (0.50)
SCHEMBL10466224 0.79 HTT (0.51)
SCHEMBL1922270 0.75 ALDH1A1 (0.50)
SCHEMBL7698024 0.75 ALDH1A1 (0.50)
SCHEMBL10465840 0.74 IDO1 (0.41)
SCHEMBL9613866 0.73 L3MBTL1 (0.35)
SCHEMBL10466206 0.72 ALDH1A1 (0.48)
SCHEMBL3483047 0.72 IDO1 (0.40)

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

Appears in 5408 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6384031-B1 None US claimed
CN-118271331-A Gelsemin derivatives, synthesis method and application thereof in inhibiting tumor cell proliferation 赣江中药创新中心 2024-07-02 CN claimed
WO-2023190015-A1 1-ARYL TETRAHYDROPYRIDAZINE-3,5-DIONE DERIVATIVE OR SALT THEREOF, PESTICIDE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAME 日本農薬株式会社 2023-10-05 WO claimed
WO-2023127805-A1 ARYL TETRAHYDROPYRIDAZINE DERIVATIVE OR SALT THEREOF, PESTICIDE CONTAINING SAID COMPOUND, AND METHOD FOR USING SAME 日本農薬株式会社 2023-07-06 WO claimed
CN-115867670-A Base-modified nucleotides as substrates for TDT-based enzyme nucleic acids 伊鲁米纳新加坡有限公司 2023-03-28 CN claimed
EP-3914706-A1 METHODS AND COMPOSITIONS OF ACCELERATING REACTIONS FOR POLYPEPTIDE ANALYSIS AND RELATED USES Encodia, Inc. (US) 2021-12-01 EP claimed
CN-113557299-A Methods and compositions for accelerating polypeptide analysis reactions and related uses ENCODIA 公司 2021-10-26 CN claimed
EP-3762408-A1 CHEMO-ENZYMATIC SYNTHESIS OF SEMAGLUTIDE, LIRAGLUTIDE AND GLP-1 Enzypep B.V. (NL) 2021-01-13 EP claimed
CN-111757891-A Chemical-enzymatic synthesis of somaglutide, liraglutide and GLP-1 恩细贝普有限公司 2020-10-09 CN claimed
WO-2020154208-A1 METHODS AND COMPOSITIONS OF ACCELERATING REACTIONS FOR POLYPEPTIDE ANALYSIS AND RELATED USES Encodia, Inc. (US) 2020-07-30 WO claimed
EP-0050298-A2 1-(1,3-Dioxolan-2-ylmethyl) azoles, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1982-04-28 EP claimed
US-4327097-A BACTERICIDES FOR MAMMALS TOYAMA CHEMICAL CO., LTD. (JP) 1982-04-27 US claimed
US-4258188-A HYPOTENSIVE AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-03-24 US claimed
EP-0022481-A1 5,6-Alkylenepyrimidine derivatives, processes for preparing the same and pharmaceutical compositions Mitsubishi Yuka Pharmaceutical Co., Ltd. (JP) 1981-01-21 EP claimed
US-4246405-A Method for preparation of β-lactam compound FUJISAWA PHARMACEUTICAL COMPANY, LIMITED (JP) 1981-01-20 US claimed
US-4219554-A Novel penicillins and cephalosporins and process for producing same TOYAMA CHEMICAL COMPANY, LIMITED (JP) 1980-08-26 US claimed
EP-0007477-A1 1-(3-Mercapto-2-methylpropanoyl)prolyl amino acid derivatives and salts thereof, processes for their preparation, and pharmaceutical compositions containing such compounds Dainippon Pharmaceutical Co., Ltd. (JP) 1980-02-06 EP claimed
US-4112090-A BACTERICIDE TOYAMA CHEMICAL CO., LTD. (JP) 1978-09-05 US claimed
US-4076819-A ANTIINFLAMMATORY AGENTS, INHIBITOR OF BLOOD PLATELET AGGREGATION PARCOR (FR) 1978-02-28 US claimed
US-3934008-A PEPTIDES, HYPOCALCAEMIC CIBA-GEIGY CORPORATION (US) 1976-01-20 US claimed