SCHEMBL533350

SCHEMBL533350

CCC(C#N)CC

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
SCHEMBL15309950 0.86 TSHR (0.41)
SCHEMBL15310039 0.86 TSHR (0.33)
SCHEMBL13186335 0.83 TSHR (0.32)
SCHEMBL14216330 0.83 TSHR (0.32)
SCHEMBL19729650 0.83 TSHR (0.32)
Phosphoric Acid SCHEMBL2580447 0.83 LAP3 (0.39)
Phosphonic Acid SCHEMBL6769953 0.83
SCHEMBL464424 0.81
SCHEMBL14546289 0.81
SCHEMBL7458495 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4568959-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-06-18 EP claimed
CN-118240396-A Reinforced fiber for composite floor and preparation method thereof 广西大自然智能家居有限公司 2024-06-25 CN claimed
CN-113498342-A Compounds involved in synergistic binding and uses thereof 锐新医药公司 2021-10-12 CN claimed
CN-108178724-B Process for the preparation of compounds 四川大学 2020-09-11 CN claimed
US-9345247-B2 Azaindole carboxylic acid amides and azaindole thiocarboxylic acid amides for use as insecticides and acaricides BAYER CROPSCIENCE AG (DE) 2016-05-24 US claimed
US-20150216175-A1 AZAINDOLE CARBOXYLIC ACID AMIDES AND AZAINDOLE THIOCARBOXYLIC ACID AMIDES FOR USE AS INSECTICIDES AND ACARICIDES BAYER CROPSCIENCE AG (DE) 2015-08-06 US claimed
EP-2885301-A1 AZAINDOLE CARBOXYLIC ACID AMIDES AND AZAINDOLE THIOCARBOXYLIC ACID AMIDES FOR USE AS INSECTICIDES AND ACARICIDES Bayer CropScience AG (DE) 2015-06-24 EP claimed
EP-2683688-B1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES BAYER IP GMBH (DE) 2015-05-06 EP claimed
US-8895478-B2 Degradable polymer compositions and uses thereof ISP INVESTMENTS INC. (US) 2014-11-25 US claimed
US-20140088167-A1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-03-27 US claimed
WO-2001001446-A1 METHOD AND APPARATUS FOR DISCRIMINATING IONS HAVING THE SAME NOMINAL MASS TO CHARGE RATIO THERMO ELECTRON CORPORATION (US) 2001-01-04 WO claimed
US-RE36617-E Anastrozole and salts as anticancer agent ZENECA LIMITED (GB) 2000-03-14 US claimed
CN-1194635-A Multi-component liquid azodinitrine mixtures DU PONT (US) 1998-09-30 CN claimed
EP-0296749-B1 (Substituted aralkyl) heterocyclic compounds ZENECA LTD (GB) 1994-10-26 EP claimed
EP-0409413-B1 Diaryl ether heterocycles ICI PLC (GB) 1994-08-03 EP claimed
US-5208259-A Lipoxygenase enzyme inhibitors IMPERIAL CHEMICAL INDUSTRIES (GB) 1993-05-04 US claimed
EP-0409413-A2 Diaryl ether heterocycles IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-23 EP claimed
US-4935437-A (Substituted aralkyl) heterocyclic compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-19 US claimed
EP-0296749-A1 (Substituted aralkyl) heterocyclic compounds ZENECA LIMITED (GB) 1988-12-28 EP claimed
US-4401458-A HERBICIDES AND PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1983-08-30 US claimed