SCHEMBL104701

SCHEMBL104701

CCCC(=O)CC(C)C

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
SCHEMBL7520831 0.92 CYP2C19 (0.46)
SCHEMBL1948119 0.87 ALDH1A1 (0.40)
SCHEMBL108545 0.84 CES1 (0.48)
SCHEMBL11604570 0.84 CES2 (0.39)
SCHEMBL2050674 0.83 CES2 (0.43)
SCHEMBL8096693 0.83 ALDH1A1 (0.48)
Butane SCHEMBL5614872 0.82 CYP2C19 (0.52)
SCHEMBL2092642 0.82 KMT2A (0.52)
Methyl Isobutyl Ketone SCHEMBL22321104 0.82 ALDH1A1 (0.67)
SCHEMBL28649278 0.82 ALDH1A1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260076371-A1 AGROCHEMICAL COMPOSITION OF TRIAZOLES ADAMA MAKHTESHIM LTD. (IL) 2026-03-19 US claimed
US-20260026501-A1 AGROCHEMICAL COMPOSITION OF SDHI FUNGICIDES ADAMA MAKHTESHIM LTD. (IL) 2026-01-29 US claimed
US-12509598-B2 Process solution composition for polymer treatment comprising a fluorine compound, a ketone solvent, and a polar aprotic solvent DONGWOO FINE-CHEM CO., LTD. (KR) 2025-12-30 US claimed
WO-2025150071-A1 A TERNARY INSECTICIDAL COMPOSITION FOR INSECTS, PESTS AND MITES RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-07-17 WO claimed
WO-2025109628-A1 A SYNERGISTIC TERNARY INSECTICIDAL COMPOSITION RAJDHANI PETROCHEMICALS PRIVATE LIMITED (IN) 2025-05-30 WO claimed
EP-4554380-A1 AGROCHEMICAL COMPOSITION OF SDHI FUNGICIDES ADAMA MAKHTESHIM LTD. (IL) 2025-05-21 EP claimed
CN-119823825-A Myrtle essential oil and application of compound essential oil based on myrtle essential oil in pest control 广东海洋大学 2025-04-15 CN claimed
US-20240261353-A1 BIOACTIVE CONCENTRATES AND USES THEREOF Purple Mondo, Inc. 2024-08-08 US claimed
CN-118005892-A Secondary amine curing agent and preparation method and application thereof 江苏大力士云石护理材料有限公司 2024-05-10 CN claimed
CN-118006270-A Low-odor low-volatility epoxy dry-hanging adhesive and preparation method thereof 江苏大力士云石护理材料有限公司 2024-05-10 CN claimed
US-6706216-B1 REACTION PRODUCT OF CATALYTIC REDUCTIVE ALKYLATION OF P-PHENYLENEDIAMINE OR DERIVATIVE WITH ACETONE AND SECOND CARBONYL COMPOUND UNIROYAL CHEMICAL COMPANY, INC. 2004-03-16 US claimed
EP-1276804-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME Uniroyal Chemical Company, Inc. (US) 2003-01-22 EP claimed
US-20020061946-A1 Liquid antiozonants and rubber compositions containing same ADDIVANT USA, LLC 2002-05-23 US claimed
WO-2001081459-A1 LIQUID ANTIOZONANTS AND RUBBER COMPOSITIONS CONTAINING SAME UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-11-01 WO claimed
EP-0984683-A2 MEANS AMD METHOD FOR PEST CONTROL OCTROOIBUREAU KISCH N.V. (AN) 2000-03-15 EP claimed
WO-1998053678-A2 MEANS AMD METHOD FOR PEST CONTROL OCTROOIBUREAU KISCH N. V. (AN) 1998-12-03 WO claimed
EP-0512519-B1 Method of producing naphthol-modified phenolic resin HITACHI CHEMICAL CO LTD (JP) 1997-03-12 EP claimed
US-5206333-A METHOD OF PRODUCING A NAPHTHOL-MODIFIED PHENOLIC RESIN OF HIGHLY INCREASED MOLECULAR WEIGHT HITACHI CHEMICAL COMPANY, LTD. (JP) 1993-04-27 US claimed
EP-0512519-A2 Method of producing naphthol-modified phenolic resin Hitachi Chemical Co., Ltd. (JP) 1992-11-11 EP claimed
US-4240983-A HALOGENATION BAYER AKTIENGESELLSCHAFT (DE) 1980-12-23 US claimed