SCHEMBL998605

SCHEMBL998605

[C-]#[N+]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
Hydrochloric Acid SCHEMBL9624548 0.97 ACHE (0.47)
SCHEMBL4351525 0.97 ACHE (0.47)
SCHEMBL12692354 0.92 ACHE (0.42)
SCHEMBL13410607 0.92 ACHE (0.42)
SCHEMBL13050828 0.87 NFE2L2 (0.54)
SCHEMBL9556680 0.87 ACHE (0.46)
SCHEMBL12908103 0.85 TEAD4 (0.52)
SCHEMBL12204621 0.83 CHRNA7 (0.41)
Carbamic Acid SCHEMBL11670769 0.83 ALDH1A1 (0.43)
SCHEMBL409015 0.83 HDAC3 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3195932-B1 HYDROSILYLATION REACTION CATALYST UNIV KYUSHU NAT UNIV CORP (JP) 2024-08-21 EP claimed
CN-113620990-B Thiourea type nitrogen phosphine ligand and preparation method and application thereof 万华化学集团股份有限公司 2022-11-08 CN claimed
EP-3269724-B1 MONONUCLEAR IRON COMPLEX AND ORGANIC SYNTHESIS REACTION USING SAME UNIV KYUSHU NAT UNIV CORP (JP) 2020-04-22 EP claimed
EP-3118205-B1 MONONUCLEAR RUTHENIUM COMPLEX AND ORGANIC SYNTHESIS REACTION USING SAME UNIV KYUSHU NAT UNIV CORP (JP) 2020-04-22 EP claimed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US claimed
US-9884316-B2 Mononuclear ruthenium complex and organic synthesis reaction using same KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2018-02-06 US claimed
US-20170012208-A1 ORGANIC SEMICONDUCTOR FORMULATIONS USINVEST LLC 2017-01-12 US claimed
US-5449799-A Compound for depositing copper layers TERFLOTH CHRISTIAN (DE) 1995-09-12 US claimed
EP-0472897-B1 Process for depositing copper containing layer II KALI CHEMIE AG (DE) 1994-12-14 EP claimed
US-5346730-A Process for depositing a copper containing layer I KALI-CHEMIE AG (DE) 1994-09-13 US claimed
EP-0468396-B1 Process for depositing a copper-containing layer KALI CHEMIE AG (DE) 1994-06-29 EP claimed
US-12296325-B2 Catalyst for hydrosilylation reaction, hydrogenation reaction, and hydrosilane reduction reaction KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2025-05-13 US disclosed
CN-112219258-B Spin-on metallization 弗萨姆材料美国有限责任公司 2024-12-31 CN disclosed
CN-118206489-B 1, 3-Phenylenediamine derivative with anti-tumor activity, preparation method and application 国王医学科技(山东)有限公司 2024-09-24 CN disclosed
EP-3184172-B1 HYDROSILYLATION IRON CATALYST UNIV KYUSHU NAT UNIV CORP (JP) 2024-09-04 EP disclosed
EP-0237079-A1 Process for trimerization UNION CARBIDE CORPORATION (US) 1987-09-16 EP disclosed
US-4668838-A OLEFIN WITH CHROMIUM, ALUMINUM, LIGAND CATALYSTS UNION CARBIDE CORPORATION (US) 1987-05-26 US disclosed
EP-0021221-B1 PROCESS FOR THE DIMERIZATION OF HEXAFLUOROPROPENE OXIDE HOECHST AKTIENGESELLSCHAFT (DE) 1982-11-24 EP disclosed
US-4303593-A CATALYSIS WITH COPPER COMPLEX HOECHST AKTIENGESELLSCHAFT (DE) 1981-12-01 US disclosed
EP-0021221-A1 Process for the dimerization of hexafluoropropene oxide HOECHST AKTIENGESELLSCHAFT (DE) 1981-01-07 EP disclosed