Acetonitrile

Acetonitrile

SCHEMBL2268920

C=C(C)C#N.CC#N

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ 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
SCHEMBL14868 0.92
SCHEMBL9859678 0.92 TDP1 (1.00)
SCHEMBL10789863 0.92
Water SCHEMBL11786429 0.92
Ethylene SCHEMBL1897636 0.88
Methyl Alcohol SCHEMBL9550434 0.88
SCHEMBL9331295 0.88
Hydrochloric Acid SCHEMBL10535007 0.88
SCHEMBL28076525 0.88
SCHEMBL27766490 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10655152-B2 Method for producing an amide SOLENIS TECHNOLOGIES, L.P. (US) 2020-05-19 US claimed
US-7987912-B2 Reversible polymeric gelation for oilfield applications SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2011-08-02 US disclosed
US-20090126932-A1 REVERSIBLE POLYMERIC GELATION FOR OILFIELD APPLICATIONS SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2009-05-21 US disclosed
CN-101027252-A Process for recovery and recycle of ammonia from a vapor stream INNOVENE USA LLC (US) 2007-08-29 CN disclosed