SCHEMBL9577981

SCHEMBL9577981

[2H]C([2H])([2H])C(=C)C#N

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
SCHEMBL10789928 0.81
SCHEMBL14868 0.78
Water SCHEMBL11786429 0.78
SCHEMBL9859678 0.78 TDP1 (1.00)
SCHEMBL10789863 0.78
Hydrochloric Acid SCHEMBL10535007 0.74
Methyl Alcohol SCHEMBL9550434 0.74
SCHEMBL9331295 0.74
Ethylene SCHEMBL1897636 0.74
Methane SCHEMBL28318606 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0303919-B1 REINFORCED THERMOPLASTIC MOULDING COMPOSITIONS, PROCESS FOR THEIR PREPARATION AND THEIR USE BASF Aktiengesellschaft (DE) 1993-01-20 EP disclosed
EP-0303919-A2 Reinforced thermoplastic moulding compositions, process for their preparation and their use BASF Aktiengesellschaft (DE) 1989-02-22 EP disclosed
EP-0200184-A1 Reinforced thermoplastic moulding mass BASF Aktiengesellschaft (DE) 1986-11-05 EP disclosed