Acetonitrile

Acetonitrile

SCHEMBL6239339

CC#N.CC#N.CC#N.CC#N.[Cl-].[Cl-].[Ru+2]

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Acetonitrile. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Acetonitrile SCHEMBL11344692 1.00
Acetonitrile SCHEMBL30802477 0.94 TSHR (0.33) TSHRALDH1A1
Acetonitrile SCHEMBL30434534 0.94 TSHR (0.33) TSHRALDH1A1
Acetonitrile SCHEMBL31303586 0.94
Acetonitrile SCHEMBL10790879 0.88
Acetonitrile SCHEMBL10898984 0.88
Acetonitrile SCHEMBL10561604 0.88
Acetonitrile SCHEMBL20357991 0.88
Acetonitrile SCHEMBL19182435 0.88
Acetonitrile SCHEMBL11516713 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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0862589-B1 ADDITION POLYMERS OF POLYCYCLOOLEFINS CONTAINING SILYL FUNCTIONAL GROUPS SUMITOMO BAKELITE CO (JP) 2004-02-18 EP claimed
EP-0828768-B1 HOMOPOLYMERS AND COPOLYMERS OF CATIONICALLY POLYMERIZABLE MONOMERS AND METHOD OF THEIR PREPARATION GOODRICH CO B F (US) 2001-04-18 EP claimed
US-6031058-A POLYMERS OF THE INVENTION INCLUDE POLYCYCLIC REPEAT UNITS THAT CONTAIN PENDANT SILYL FUNCTIONAL GROUPS THE B.F. GOODRICH COMPANY (US) 2000-02-29 US claimed
EP-0729480-B1 ADDITION POLYMERS DERIVED FROM NORBORNENE-FUNCTIONAL MONOMERS AND PROCESS THEREFOR GOODRICH CO B F (US) 1999-01-27 EP claimed
US-5741869-A REACTION MIXTURE FOR FORMING ADDITION POLYMER COMPRISING NORBORNENE-FUNCTIONAL MONOMER, SOLVENT, GROUP 8 METAL-CONTAINING CATALYST SYSTEM, CHAIN TRANSFER AGENT THE B.F. GOODRICH COMPANY (US) 1998-04-21 US claimed
EP-0828768-A1 HOMOPOLYMERS AND COPOLYMERS OF CATIONICALLY POLYMERIZABLE MONOMERS AND METHOD OF THEIR PREPARATION The B.F. Goodrich Company (US) 1998-03-18 EP claimed
EP-0758657-A2 Addition polymers derived from norbornene-functional monomers and process therefor The B.F. Goodrich Company (US) 1997-02-19 EP claimed
WO-1996037529-A1 HOMOPOLYMERS AND COPOLYMERS OF CATIONICALLY POLYMERIZABLE MONOMERS AND METHOD OF THEIR PREPARATION THE B.F. GOODRICH COMPANY (US) 1996-11-28 WO claimed
US-5571881-A Addition polymers derived from norbornene-functional monomers and process therefor THE B. F. GOODRICH COMPANY (US) 1996-11-05 US claimed
EP-0729480-A1 ADDITION POLYMERS DERIVED FROM NORBORNENE-FUNCTIONAL MONOMERS AND PROCESS THEREFOR The B.F. Goodrich Company (US) 1996-09-04 EP claimed
WO-1995014048-A1 ADDITION POLYMERS DERIVED FROM NORBORNENE-FUNCTIONAL MONOMERS AND PROCESS THEREFOR THE B.F. GOODRICH COMPANY (US) 1995-05-26 WO claimed
US-9468898-B2 Reactor, reaction method, and reaction product KOBE STEEL, LTD. (JP) 2016-10-18 US disclosed
US-20150314258-A1 REACTOR, REACTION METHOD, AND REACTION PRODUCT KABUSHIKI KAISHA KOBE SEIKO SHO (KOBE STEEL, LTD.) (JP) 2015-11-05 US disclosed
EP-0885405-B1 PHOTORESIST COMPOSITIONS COMPRISING POLYCYCLIC POLYMERS WITH ACID LABILE PENDANT GROUPS SUMITOMO BAKELITE CO (JP) 2005-06-08 EP disclosed
US-6790579-B1 PHOTOACID INITIATOR GENERATES ACID EFFECTING POLARITY CHANGE RENDERING POLYMER WATER SOLUBLE IN AREAS EXPOSED TO IMAGING SOURCE; INTEGRATED CIRCUITS, SEMICONDUCTORS SUMITOMO BAKELITE CO., LTD. (JP) 2004-09-14 US disclosed
US-5677405-A COPOLYMER OF NORBORNENE-TYPE MONOMER WHICH UNDERGOES ADDITION POLYMERIZATION AND CATIONICALLY POLYMERIZABLE MONOMER THE B.F. GOODRICH COMPANY (US) 1997-10-14 US disclosed
WO-1997033198-A1 PHOTORESIST COMPOSITIONS COMPRISING POLYCYCLIC POLYMERS WITH ACID LABILE PENDANT GROUPS THE B.F. GOODRICH COMPANY (US) 1997-09-12 WO disclosed
EP-0758657-A2 Addition polymers derived from norbornene-functional monomers and process therefor The B.F. Goodrich Company (US) 1997-02-19 EP disclosed
US-5571881-A Addition polymers derived from norbornene-functional monomers and process therefor THE B. F. GOODRICH COMPANY (US) 1996-11-05 US disclosed
US-5569730-A HAVING TERMINAL END GROUP DERIVED FROM CHAIN TRANSFER AGENT CONTAINING TERMINAL OLEFINIC DOUBLE BOND THE B. F. GOODRICH COMPANY (US) 1996-10-29 US disclosed