Carboxin

Carboxin

SCHEMBL4288360

CC1=C(C(=O)Nc2ccccc2)SCCO1.Cc1occc1C(=O)Nc1ccccc1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.77
HSD17B10 Q99714 2/20 0.77
NPC1 O15118 7/20 0.52
RAB9A P51151 6/20 0.52
SMN1; SMN2 Q16637 6/20 0.52
GAA P10253 1/20 0.52
HTT P42858 3/20 0.51
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 4/20 0.50
TP53 P04637 2/20 0.50
PKM P14618 2/20 0.50
HPGD P15428 2/20 0.50
GPR55 Q9Y2T6 1/20 0.50
ESR2 Q92731 1/20 0.50
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
ALOX15 P16050 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49

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
Carboxin SCHEMBL8819780 0.88 MAPK1 (1.00) MAPK1HSD17B10NPC1RAB9AKMT2A
Carboxin SCHEMBL18392 0.88 MAPK1 (1.00) MAPK1HSD17B10NPC1RAB9AKMT2A
Carboxin SCHEMBL20746329 0.83 MAPK1 (0.90) MAPK1HSD17B10NPC1RAB9AKMT2A
Fenfuram SCHEMBL18978 0.81 SMN1; SMN2 (0.73) MAPK1HSD17B10NPC1RAB9ASMN1; SMN2
Carboxin SCHEMBL8819779 0.77 MAPK1 (0.77) MAPK1HSD17B10NPC1RAB9AKMT2A
SCHEMBL8930142 0.77 MAPK1 (0.70) MAPK1HSD17B10NPC1RAB9AKMT2A
Carboxin SCHEMBL30843999 0.76 MAPK1 (0.76) MAPK1HSD17B10NPC1RAB9AKMT2A
Oxycarboxin SCHEMBL4175380 0.76 MAPK1 (0.76) MAPK1HSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL9442138 0.75 MAPK1 (0.74) MAPK1HSD17B10NPC1RAB9ASMN1; SMN2
Carboxin SCHEMBL11599421 0.75 MAPK1 (0.72) MAPK1HSD17B10NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5290791-A Fungicidal composition for seed dressing RHONE-POULENC SECTEUR AGROCHIMIE (FR) 1994-03-01 US claimed
CN-101421218-B Cycloalkyl-phenylsubstituierte cyclische ketoenole BAYER CROPSCIENCE AG 2012-12-19 CN disclosed
US-8227573-B2 Utility of phylloplanins as antibiotics, selective fungicides and for enhancing microbial resistance in plants UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2012-07-24 US disclosed
US-20090281038-A1 Phylloplanins Inhibition of Microbial Growth on Organic Materials UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2009-11-12 US disclosed
US-20090215667-A1 Utility of phylloplanins as antibiotics, selective fungicides and for enhancing microbial resistance in plants UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2009-08-27 US disclosed