SCHEMBL4454

SCHEMBL4454

CNc1ccccc1

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
SCHEMBL3008675 1.00 — —
SCHEMBL19298582 1.00 TSHR (1.00) —
Benzene SCHEMBL17977991 1.00 TSHR (1.00) —
Hydrochloric Acid SCHEMBL7032201 0.97 TSHR (0.93) —
Dimethylamine SCHEMBL7642350 0.97 TSHR (0.93) —
Ammonia Solution, Strong SCHEMBL7932140 0.97 — —
Water SCHEMBL486305 0.97 — —
SCHEMBL7709427 0.97 — —
Iodide SCHEMBL22092509 0.97 — —
Hydrochloric Acid SCHEMBL2637990 0.97 — —

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 49154 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613216-B Toluene purification treatment method and application thereof Wanhua Chemical Group (Fujian) Isocyanate Co.,Ltd. (CN) 2026-05-26 — — CN claimed
CN-122080900-A Mannich base quaternary ammonium salt corrosion inhibitor for ultrahigh-temperature well acidification and preparation method thereof — 2026-05-26 — — CN claimed
CN-122095027-A Modified maleated natural oil-based reaction products and slurry compositions containing the same — 2026-05-26 — — CN claimed
CN-117361734-B Process and equipment for removing methylaniline and indole in coking nanofiltration concentrated water, catalyst and preparation method thereof 宝山钢铁股份有限公司 2026-05-19 — — CN claimed
CN-118005569-B 6-Aminoquinoxaline compound and preparation method and application thereof 华南理工大学 2026-05-19 — — CN claimed
CN-122036522-A Multi-tower rectifying method and multi-tower rectifying system 苏尔寿化工(上海)有限公司 2026-05-15 — — CN claimed
CN-122055416-A Dispersants for carbon nanotubes and carbon nanotube compositions comprising hydrophobically and hydrophilically modified maleated natural oil salts 埃斯普投资有限公司 2026-05-15 — — CN claimed
CN-122008382-A Multi-scale inorganic structure and printing manufacturing method thereof 大连理工大学 2026-05-12 — — CN claimed
US-12617819-B2 Intermediate used for biologically active polypeptide and method for preparing same HANMI FINE CHEMICAL CO., LTD. (KR) 2026-05-05 — — US claimed
US-20260120966-A1 METHODS OF FABRICATION OF ENVIRONMENTALLY FRIENDLY SUPERTCAPACITOR AND PERFORMANCE FOR REAL WORLD APPLICATIONS RAM MANOJ KUMAR (US) 2026-04-30 — — US claimed
US-3993646-A Process for the ring expansion of penicillins to cephalosporin compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-11-23 — — US claimed
US-3973981-A PHTHALOCYANINE DYES, PAINTS, INKS TOYO INK MANUFACTURING CO., LTD. (JA) 1976-08-10 — — US claimed
US-3960857-A Urea additives for sulfur vulcanizable polymers THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-06-01 — — US claimed
US-3954729-A FROM A SECONDARY AMINE, CARBONYL SULFIDE, AND AN ALKYL HALIDE IHARA CHEMICAL INDUSTRY CO., LTD. (JA) 1976-05-04 — — US claimed
US-3947405-A Process for making neohesperidine dihydrochalcone GIVAUDAN CORPORATION (US) 1976-03-30 — — US claimed
US-3947395-A Epoxy surface coating compositions HITACHI, LTD. (JA) 1976-03-30 — — US claimed
US-3933717-A Water soluble linear macroamine polymers and method of producing them B. R. CHEMICAL CO., LTD. (JA) 1976-01-20 — — US claimed
US-3932565-A USED TO MAKE FLAME-RETARDANT POLYURETHANES UNIROYAL INC. (US) 1976-01-13 — — US claimed
US-3932528-A STABILIZATION WITH A NITROGEN BASE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-13 — — US claimed
US-3931320-A FROM AN AROMATIC PRIMARY OR SECONDARY AMINE, FORMALDEHYDE, ACID CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 — — US claimed
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