3-Methylbutanoic Acid

3-Methylbutanoic Acid

SCHEMBL5842501

CC(C)CC(=O)[O-].CC(C)CC(=O)[O-].CC(C)CC(=O)[O-].CC(C)CC(=O)[O-].[U+4]

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.88
CA1 P00915 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA4 P22748 2/20 0.46
SLC22A16 Q86VW1 1/20 0.44
CTSL P07711 1/20 0.42
CPT2 P23786 1/20 0.41
CPT1A P50416 1/20 0.41

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
3-Methylbutanoic Acid SCHEMBL29461587 0.97 CA2 (0.94) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL5462119 0.94
3-Methylbutanoic Acid SCHEMBL3682595 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL8572469 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL9124487 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL8388209 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL9124489 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL8572668 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL8570885 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4
3-Methylbutanoic Acid SCHEMBL3182324 0.94 CA2 (0.88) CA2CA1ALDH1A1TDP1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7153805-B2 Group III-B metal catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-12-26 US disclosed
US-7022783-B2 synthesis of non tapered, random isoprene-butadiene rubbers with a catalyst made of a Group III-B organometalic compound and an organoaluminum compound and a halogen compound; tire sidewalls with improved cut growth resistance without sacrificing rolling resistance THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-04-04 US disclosed
US-20060020090-A1 Group III-B metal catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2006-01-26 US disclosed
US-20040186252-A1 Group III-B metal catalyst system GOODYEAR TIRE & RUBBER COMPANY, THE 2004-09-23 US disclosed
US-6713565-B2 HAVING SOLID CORE COMPRISED OF POLYBUTADIENE RUBBER POLYMERIZED IN PRESENCE OF ZIEGLER-NATTA CATALYST AND CARBOXYLIC ACID SHORT STOPPED; HIGH SPEED RESILIENCE THE GOODYEAR TIRE & RUBBER COMPANY 2004-03-30 US disclosed
US-20030125487-A1 Copolymerizing isoprene and 1,3- butadiene in a catalyst system of a labile halogen atom compound and a reaction product of an organoaluminum, an alcohol, a silanol, 1,3-butadiene and an orgnaometallic compound THE GOODYEAR TIRE & RUBBER COMPANY 2003-07-03 US disclosed
US-20030013556-A1 Golf ball GOODYEAR TIRE & RUBBER COMPANY, THE 2003-01-16 US disclosed
US-20020137849-A1 Cis-1,4-polybutadiene that is synthesized utilizing organometallic catalyst systems; polymerization is short-stopped with a fatty alcohol KERNS MICHAEL LESTER (US) 2002-09-26 US disclosed
EP-0629640-B1 Process for the synthesis of isoprene-butadiene rubber GOODYEAR TIRE & RUBBER (US) 1997-01-08 EP disclosed
US-5502126-A Process for the synthesis of isoprene butadiene rubber THE GOODYEAR TIRE & RUBBER COMPANY (US) 1996-03-26 US disclosed
EP-0629640-A1 Process for the synthesis of isoprene-butadiene rubber THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-12-21 EP disclosed
US-5321085-A Polymerizing diisocyanate and diol in polymeric cement, recovering THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-06-14 US disclosed
US-5283294-A Crystalline polymer in rubber elastomer THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-02-01 US disclosed
US-5283291-A High modulus rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1994-02-01 US disclosed
EP-0489216-A1 High modulus rubber compositions THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-06-10 EP disclosed
US-5049620-A High modulus rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-09-17 US disclosed
EP-0434596-A2 High modulus rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-06-26 EP disclosed
EP-0336874-A1 Inverse phase polymerization THE GOODYEAR TIRE & RUBBER COMPANY (US) 1989-10-11 EP disclosed
EP-0241996-A2 Molecular weight modifier for use with lanthanide and actinide catalysts ENICHEM ELASTOMERI S.r.l. (IT) 1987-10-21 EP disclosed
US-4663405-A ADDITION POLYMERIZATION COORDINATION CATALYSTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1987-05-05 US disclosed