SCHEMBL12596

SCHEMBL12596

CCc1cc(C)ccn1

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
SCHEMBL31421768 1.00 — —
SCHEMBL27440094 0.98 UHRF1 (0.50) —
Bromide SCHEMBL28271991 0.98 UHRF1 (0.50) —
SCHEMBL7463369 0.88 SREBF1 (0.43) —
SCHEMBL30932457 0.83 UHRF1 (0.54) —
SCHEMBL7893402 0.82 KDM4E (0.55) —
Alcohol SCHEMBL4857638 0.80 UHRF1 (0.46) —
SCHEMBL13725194 0.79 — —
SCHEMBL510744 0.79 — —
SCHEMBL12892594 0.79 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025032111-A1 METHOD FOR RECOVERING METHYL AND VINYL SUBSTITUTED PYRIDINES ARXADA AG (CH) 2025-02-13 — — WO disclosed
US-20240209000-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC 2024-06-27 — — US disclosed
WO-2024071216-A1 PYRAZOLE COMPOUND AND PEST CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT 三井化学クロップ&ライフソリューション株式会社 2024-04-04 — — WO disclosed
US-11858930-B2 Fused bicyclic RAF inhibitors and methods for use thereof JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2024-01-02 — — US disclosed
EP-3983078-B1 NEXT-GENERATION MODULATORS OF STIMULATOR OF INTERFERON GENES (STING) RYVU THERAPEUTICS S A (PL) 2023-11-15 — — EP disclosed
WO-2023205595-A2 EGFR INHIBITORS IN CANCER TREATMENT CELYN THERAPEUTICS, INC (US) 2023-10-26 — — WO disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 — — US disclosed
WO-2023171783-A1 PYRAZOLE COMPOUND, AND NOXIOUS ORGANISM CONTROL AGENT CONTAINING SAME AS ACTIVE INGREDIENT 三井化学アグロ株式会社 2023-09-14 — — WO disclosed
EP-3466929-B1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS MILLENNIUM PHARM INC (US) 2023-09-06 — — EP disclosed
WO-2023146987-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
US-4724003-A Asphalt compositions containing anti-stripping additives prepared from hydrocarbyl substituted nitrogen-containing aromatic heterocyclic compounds, aldehydes or ketones and amines THE DOW CHEMICAL COMPANY (US) 1988-02-09 — — US disclosed
US-4676834-A Novel compositions prepared from methyl substituted nitrogen-containing aromatic heterocyclic compounds and an aldehyde or ketone THE DOW CHEMICAL COMPANY (US) 1987-06-30 — — US disclosed
EP-0209376-A2 An electrolyte for electrolytic capacitor NIPPON CHEMI-CON CORPORATION (JP) 1987-01-21 — — EP disclosed
US-4493818-A Phosgene removal process THE DOW CHEMICAL COMPANY (US) 1985-01-15 — — US disclosed
US-4341720-A FROM AN OXALIC ACID COMPOUND AND PHOSPHORUS PENTACHLORIDE IN PRESENCE OF A TERTIARY AMINE COMPOUND BAYER AKTIENGESELLSCHAFT (DE) 1982-07-27 — — US disclosed
EP-0009658-B1 PROCESS FOR THE PREPARATION OF OXALYL CHLORIDE BAYER AG (DE) 1981-08-26 — — EP disclosed
US-4212842-A HETEROCYCLIC IMINE PETROLITE CORPORATION (US) 1980-07-15 — — US disclosed
EP-0009658-A1 Process for the preparation of oxalyl chloride BAYER AG (DE) 1980-04-16 — — EP disclosed
US-4042602-A Synthesis of dideoxyzearalane and related compounds IMC CHEMICAL GROUP, INC. (US) 1977-08-16 — — US disclosed
US-3976593-A TRIETHANOLAMINE BISULFITE, CORROSION INHIBITOR PETROLITE CORPORATION (US) 1976-08-24 — — US disclosed
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