Butane

Butane

SCHEMBL7717037

CC(CP(=O)(O)O)C(C)C(=O)O.CCCC

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
FOLH1 Q04609 10/20 0.41
METAP1 P53582 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.38
FDPS P14324 1/20 0.37

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
Butane SCHEMBL7718872 0.78 FOLH1 (0.48) FNTAFNTBFOLH1METAP1NAALAD2
SCHEMBL11334546 0.74 FOLH1 (0.43) FOLH1NAALAD2
Butane SCHEMBL7009352 0.73 FDPS (0.42) FNTAFNTBMETAP1FDPS
SCHEMBL462556 0.72 SLC7A5 (0.46) FOLH1METAP1
SCHEMBL417728 0.72 SLC7A5 (0.46) FOLH1METAP1
Butane SCHEMBL7716767 0.71 FOLH1 (0.50) FNTAFNTBFOLH1METAP1NAALAD2
SCHEMBL1572707 0.70 CHRM1 (0.52) METAP1
SCHEMBL4447254 0.70 CHRM1 (0.52) METAP1
SCHEMBL1304832 0.70 FOLH1 (0.48) FOLH1NAALAD2
SCHEMBL11329707 0.69 FOLH1 (0.39) FOLH1NAALAD2

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-6376512-B1 FOR TREATING PHYSIOLOGICAL CONDITION IN PATIENT WHEREIN SAID CONDITION IS ASSOCIATED WITH A PHYSIOLOGICALLY DETRIMENTAL LEVELS OF INSULIN, GLUCOSE, FREE FATTY ACIDS, OR TRIGLYCERIDES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-23 US disclosed
EP-0315399-B1 Quinoline derivatives, their use in the treatment of hypersensitive ailments and a pharmaceutical composition containing the same RHONE POULENC RORER INT (US) 1996-01-10 EP disclosed
US-5059610-A QUINOLINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF LEUKOTRIENE D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-10-22 US disclosed
US-4920132-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed