SCHEMBL8036341

SCHEMBL8036341

C=CC(C)c1[c]cccc1

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
SCHEMBL16295809 0.80
SCHEMBL1233149 0.76
SCHEMBL16426499 0.76
SCHEMBL5424032 0.75
SCHEMBL1436256 0.75
SCHEMBL2049372 0.75 ALDH1A1 (0.31)
SCHEMBL11116133 0.75
SCHEMBL96104 0.75
SCHEMBL4433093 0.75
SCHEMBL4025057 0.75

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805795-B1 NOVEL AROMATIC AMIDES, METHOD FOR PREPARING AND COMPOSITIONS CONTAINING SAME, AND USE THEREOF AS PESTICIDES HOECHST SCHERING AGREVO SA (FR) 2000-08-23 EP claimed
US-6159973-A Aromatic amides, their preparation process, the compositions containing them and their use as pesticides HOECHST SCHERING AGREVO S.A. (FR) 2000-12-12 US disclosed
US-6013837-A E.G.,4-(2-(3,4,5-TRICHLORO PHENYL) 1-FLUOROCYCLOPROPYL)-N-(2-METHYL PHENYL)BENZAMIDE; PARTICULAR USE AGAINST ARTHROPODS, HELMINTHS AND MOLLUSCS; INSECTICIDES; ACARICIDES; NEMATICIDES; PHOTOSTABILITY; NONTOXIC TO MAMMALS HOECHST MARION ROUSSEL (FR) 2000-01-11 US disclosed
EP-0012452-B1 PHOSPHORIC ACID ESTERS AND THEIR USE IN PESTICIDAL COMPOSITIONS BAYER AG (DE) 1983-02-09 EP disclosed
EP-0000127-B1 INSECTICIDAL AND ACARICIDAL COMPOSITIONS, THEIR MANUFACTURE AND THEIR USE BAYER AG (DE) 1982-10-20 EP disclosed
EP-0030661-A2 Insecticidal and acaricidal agents containing propargyl esters of thiono-phosphoric acids BAYER AG (DE) 1981-06-24 EP disclosed
US-4257987-A SYNERGISTIC ARTHROPODICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-03-24 US disclosed
EP-0025179-A1 Process for the preparation of methane-phosphonic acid esters containing propargyl groups BAYER AG (DE) 1981-03-18 EP disclosed
EP-0012452-A2 Phosphoric acid esters and their use in pesticidal compositions BAYER AG (DE) 1980-06-25 EP disclosed
EP-0000127-A1 Insecticidal and acaricidal compositions, their manufacture and their use BAYER AG (DE) 1979-01-10 EP disclosed